USER MOD reduce.3.24.130724 H: found=0, std=0, add=904, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 905 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 115 ASN : amide:sc= -0.0469 X(o=-0.03,f=-0.24) USER MOD Set 1.2: A 117 THR OG1 : rot 180:sc= 0.017 USER MOD Set 2.1: A 44 HIS : no HE2:sc= 1.15 K(o=1.4,f=-7.2!) USER MOD Set 2.2: A 103 SER OG : rot 67:sc= 0.212 USER MOD Set 3.1: A 33 SER OG : rot -116:sc= 0.104 USER MOD Set 3.2: A 35 THR OG1 : rot 180:sc= 0.217 USER MOD Set 4.1: A 27 MET CE :methyl -149:sc= -0.108 (180deg=-1.32) USER MOD Set 4.2: A 99 CYS SG : rot -59:sc= -0.801 USER MOD Set 5.1: A 25 LYS NZ :NH3+ -166:sc= 2.23 (180deg=0.746) USER MOD Set 5.2: A 28 GLN : amide:sc= 2.13 K(o=4.4,f=-5.3) USER MOD Single : A 19 HIS : no HE2:sc= -0.694 C(o=0.64!,f=-11!) USER MOD Single : A 32 ASN : amide:sc=-0.00908 K(o=-0.0091,f=-1.1) USER MOD Single : A 37 LYS NZ :NH3+ -136:sc= -0.631 (180deg=-2.46!) USER MOD Single : A 39 GLN : amide:sc= 0.957 K(o=0.96,f=-0.9) USER MOD Single : A 46 HIS : no HE2:sc= 0.959 K(o=0.96,f=-4.6!) USER MOD Single : A 47 THR OG1 : rot 180:sc= -0.569 USER MOD Single : A 52 GLN : amide:sc= -0.113 K(o=-0.11,f=-0.9) USER MOD Single : A 53 SER OG : rot 72:sc= 1.21 USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 SER OG : rot 180:sc= 0.00421 USER MOD Single : A 77 ASN : amide:sc= 0 X(o=0,f=-0.02) USER MOD Single : A 79 GLN : amide:sc= 0 K(o=0,f=-0.71) USER MOD Single : A 83 GLN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 84 GLN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 88 GLN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 91 LYS NZ :NH3+ 171:sc= 1.25 (180deg=0.823) USER MOD Single : A 94 LYS NZ :NH3+ -163:sc= -1.79! (180deg=-2.66!) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 ASN : amide:sc= -1.42 X(o=-1.4,f=-1.4) USER MOD Single : A 108 MET CE :methyl -151:sc= -1.88 (180deg=-3.69!) USER MOD Single : A 113 ASN : amide:sc= -1.76 K(o=-1.8,f=0) USER MOD Single : A 122 ASN : amide:sc= -0.338 K(o=-0.34,f=-2.3!) USER MOD Single : A 123 THR OG1 : rot -22:sc= 0.275 USER MOD Single : A 130 ASN : amide:sc= -4.56! C(o=-4.6!,f=-11!) USER MOD Single : A 132 LYS NZ :NH3+ 162:sc= 0.146 (180deg=-0.702!) USER MOD Single : A 135 GLN : amide:sc= -0.0119 K(o=-0.012,f=-0.83) USER MOD ----------------------------------------------------------------- ATOM 308 N VAL A 18 0.850 9.135 7.033 1.00 0.00 N ATOM 309 CA VAL A 18 -0.153 8.861 6.018 1.00 0.00 C ATOM 310 C VAL A 18 0.387 7.817 5.045 1.00 0.00 C ATOM 311 O VAL A 18 -0.351 7.232 4.255 1.00 0.00 O ATOM 312 CB VAL A 18 -0.548 10.147 5.252 1.00 0.00 C ATOM 313 CG1 VAL A 18 -1.711 9.892 4.304 1.00 0.00 C ATOM 314 CG2 VAL A 18 -0.893 11.265 6.223 1.00 0.00 C ATOM 0 HA VAL A 18 -1.048 8.481 6.510 1.00 0.00 H new ATOM 0 HB VAL A 18 0.311 10.454 4.656 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -1.964 10.815 3.782 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -1.428 9.130 3.578 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -2.575 9.549 4.873 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -1.168 12.160 5.665 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -1.730 10.957 6.850 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -0.029 11.481 6.852 1.00 0.00 H new ATOM 324 N HIS A 19 1.685 7.563 5.151 1.00 0.00 N ATOM 325 CA HIS A 19 2.382 6.641 4.261 1.00 0.00 C ATOM 326 C HIS A 19 1.760 5.250 4.331 1.00 0.00 C ATOM 327 O HIS A 19 1.633 4.555 3.319 1.00 0.00 O ATOM 328 CB HIS A 19 3.862 6.570 4.652 1.00 0.00 C ATOM 329 CG HIS A 19 4.715 5.859 3.653 1.00 0.00 C ATOM 330 ND1 HIS A 19 5.576 4.830 3.974 1.00 0.00 N ATOM 331 CD2 HIS A 19 4.849 6.056 2.324 1.00 0.00 C ATOM 332 CE1 HIS A 19 6.200 4.431 2.884 1.00 0.00 C ATOM 333 NE2 HIS A 19 5.774 5.158 1.870 1.00 0.00 N ATOM 0 H HIS A 19 2.285 7.990 5.856 1.00 0.00 H new ATOM 0 HA HIS A 19 2.292 7.007 3.238 1.00 0.00 H new ATOM 0 HB2 HIS A 19 4.242 7.583 4.785 1.00 0.00 H new ATOM 0 HB3 HIS A 19 3.950 6.067 5.615 1.00 0.00 H new ATOM 0 HD1 HIS A 19 5.709 4.440 4.907 1.00 0.00 H new ATOM 0 HD2 HIS A 19 4.323 6.788 1.729 1.00 0.00 H new ATOM 0 HE1 HIS A 19 6.936 3.642 2.830 1.00 0.00 H new ATOM 342 N GLU A 20 1.385 4.867 5.535 1.00 0.00 N ATOM 343 CA GLU A 20 0.802 3.569 5.797 1.00 0.00 C ATOM 344 C GLU A 20 -0.704 3.598 5.550 1.00 0.00 C ATOM 345 O GLU A 20 -1.244 2.781 4.801 1.00 0.00 O ATOM 346 CB GLU A 20 1.073 3.162 7.254 1.00 0.00 C ATOM 347 CG GLU A 20 2.474 3.509 7.756 1.00 0.00 C ATOM 348 CD GLU A 20 2.579 4.909 8.358 1.00 0.00 C ATOM 349 OE1 GLU A 20 2.425 5.901 7.617 1.00 0.00 O ATOM 350 OE2 GLU A 20 2.849 5.022 9.572 1.00 0.00 O ATOM 0 H GLU A 20 1.478 5.453 6.365 1.00 0.00 H new ATOM 0 HA GLU A 20 1.256 2.843 5.123 1.00 0.00 H new ATOM 0 HB2 GLU A 20 0.339 3.648 7.897 1.00 0.00 H new ATOM 0 HB3 GLU A 20 0.921 2.087 7.353 1.00 0.00 H new ATOM 0 HG2 GLU A 20 2.774 2.777 8.506 1.00 0.00 H new ATOM 0 HG3 GLU A 20 3.179 3.425 6.929 1.00 0.00 H new ATOM 357 N LEU A 21 -1.364 4.571 6.170 1.00 0.00 N ATOM 358 CA LEU A 21 -2.823 4.659 6.169 1.00 0.00 C ATOM 359 C LEU A 21 -3.392 4.861 4.765 1.00 0.00 C ATOM 360 O LEU A 21 -4.459 4.336 4.444 1.00 0.00 O ATOM 361 CB LEU A 21 -3.298 5.789 7.093 1.00 0.00 C ATOM 362 CG LEU A 21 -3.277 5.486 8.601 1.00 0.00 C ATOM 363 CD1 LEU A 21 -1.873 5.173 9.097 1.00 0.00 C ATOM 364 CD2 LEU A 21 -3.852 6.660 9.375 1.00 0.00 C ATOM 0 H LEU A 21 -0.905 5.321 6.687 1.00 0.00 H new ATOM 0 HA LEU A 21 -3.196 3.705 6.542 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -2.676 6.665 6.911 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -4.316 6.057 6.811 1.00 0.00 H new ATOM 0 HG LEU A 21 -3.891 4.601 8.769 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -1.903 4.965 10.167 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -1.486 4.302 8.569 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -1.223 6.028 8.912 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -3.833 6.437 10.442 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -3.256 7.551 9.180 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -4.880 6.835 9.059 1.00 0.00 H new ATOM 376 N ALA A 22 -2.684 5.614 3.932 1.00 0.00 N ATOM 377 CA ALA A 22 -3.146 5.892 2.572 1.00 0.00 C ATOM 378 C ALA A 22 -3.294 4.610 1.760 1.00 0.00 C ATOM 379 O ALA A 22 -4.174 4.502 0.906 1.00 0.00 O ATOM 380 CB ALA A 22 -2.200 6.848 1.864 1.00 0.00 C ATOM 0 H ALA A 22 -1.790 6.043 4.171 1.00 0.00 H new ATOM 0 HA ALA A 22 -4.127 6.361 2.652 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -2.564 7.040 0.855 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -2.151 7.786 2.416 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -1.206 6.404 1.813 1.00 0.00 H new ATOM 386 N ARG A 23 -2.447 3.631 2.046 1.00 0.00 N ATOM 387 CA ARG A 23 -2.464 2.379 1.306 1.00 0.00 C ATOM 388 C ARG A 23 -3.624 1.505 1.763 1.00 0.00 C ATOM 389 O ARG A 23 -4.148 0.704 0.990 1.00 0.00 O ATOM 390 CB ARG A 23 -1.129 1.654 1.460 1.00 0.00 C ATOM 391 CG ARG A 23 0.037 2.482 0.952 1.00 0.00 C ATOM 392 CD ARG A 23 1.349 1.718 0.981 1.00 0.00 C ATOM 393 NE ARG A 23 2.435 2.529 0.434 1.00 0.00 N ATOM 394 CZ ARG A 23 3.344 2.082 -0.431 1.00 0.00 C ATOM 395 NH1 ARG A 23 3.348 0.809 -0.806 1.00 0.00 N ATOM 396 NH2 ARG A 23 4.243 2.922 -0.923 1.00 0.00 N ATOM 0 H ARG A 23 -1.743 3.680 2.782 1.00 0.00 H new ATOM 0 HA ARG A 23 -2.608 2.598 0.248 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -0.969 1.411 2.510 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -1.166 0.710 0.916 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -0.169 2.806 -0.068 1.00 0.00 H new ATOM 0 HG3 ARG A 23 0.131 3.382 1.559 1.00 0.00 H new ATOM 0 HD2 ARG A 23 1.585 1.430 2.006 1.00 0.00 H new ATOM 0 HD3 ARG A 23 1.252 0.797 0.406 1.00 0.00 H new ATOM 0 HE ARG A 23 2.501 3.501 0.734 1.00 0.00 H new ATOM 0 HH11 ARG A 23 2.652 0.165 -0.431 1.00 0.00 H new ATOM 0 HH12 ARG A 23 4.048 0.475 -1.469 1.00 0.00 H new ATOM 0 HH21 ARG A 23 4.235 3.902 -0.639 1.00 0.00 H new ATOM 0 HH22 ARG A 23 4.943 2.589 -1.586 1.00 0.00 H new ATOM 410 N VAL A 24 -4.034 1.683 3.012 1.00 0.00 N ATOM 411 CA VAL A 24 -5.212 1.003 3.530 1.00 0.00 C ATOM 412 C VAL A 24 -6.463 1.532 2.840 1.00 0.00 C ATOM 413 O VAL A 24 -7.357 0.766 2.474 1.00 0.00 O ATOM 414 CB VAL A 24 -5.344 1.174 5.063 1.00 0.00 C ATOM 415 CG1 VAL A 24 -6.663 0.604 5.571 1.00 0.00 C ATOM 416 CG2 VAL A 24 -4.175 0.507 5.769 1.00 0.00 C ATOM 0 H VAL A 24 -3.568 2.292 3.684 1.00 0.00 H new ATOM 0 HA VAL A 24 -5.100 -0.061 3.321 1.00 0.00 H new ATOM 0 HB VAL A 24 -5.331 2.241 5.285 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -6.726 0.739 6.651 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -7.493 1.123 5.091 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -6.715 -0.459 5.335 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -4.280 0.635 6.846 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -4.164 -0.556 5.529 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -3.242 0.964 5.439 1.00 0.00 H new ATOM 426 N LYS A 25 -6.510 2.844 2.627 1.00 0.00 N ATOM 427 CA LYS A 25 -7.656 3.448 1.971 1.00 0.00 C ATOM 428 C LYS A 25 -7.668 3.103 0.486 1.00 0.00 C ATOM 429 O LYS A 25 -8.730 3.047 -0.129 1.00 0.00 O ATOM 430 CB LYS A 25 -7.675 4.963 2.137 1.00 0.00 C ATOM 431 CG LYS A 25 -9.067 5.535 1.944 1.00 0.00 C ATOM 432 CD LYS A 25 -9.044 6.928 1.350 1.00 0.00 C ATOM 433 CE LYS A 25 -10.455 7.473 1.182 1.00 0.00 C ATOM 434 NZ LYS A 25 -11.361 6.501 0.501 1.00 0.00 N ATOM 0 H LYS A 25 -5.776 3.499 2.897 1.00 0.00 H new ATOM 0 HA LYS A 25 -8.547 3.041 2.450 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -7.310 5.224 3.130 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -6.993 5.416 1.417 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -9.640 4.875 1.293 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -9.582 5.561 2.904 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -8.468 7.592 1.994 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -8.541 6.907 0.383 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -10.864 7.723 2.161 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -10.419 8.398 0.606 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -12.228 6.989 0.197 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -10.879 6.101 -0.329 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -11.608 5.736 1.161 1.00 0.00 H new ATOM 448 N PHE A 26 -6.489 2.887 -0.091 1.00 0.00 N ATOM 449 CA PHE A 26 -6.409 2.439 -1.476 1.00 0.00 C ATOM 450 C PHE A 26 -7.090 1.086 -1.605 1.00 0.00 C ATOM 451 O PHE A 26 -7.914 0.879 -2.495 1.00 0.00 O ATOM 452 CB PHE A 26 -4.958 2.350 -1.964 1.00 0.00 C ATOM 453 CG PHE A 26 -4.845 1.811 -3.366 1.00 0.00 C ATOM 454 CD1 PHE A 26 -5.213 2.589 -4.454 1.00 0.00 C ATOM 455 CD2 PHE A 26 -4.391 0.520 -3.593 1.00 0.00 C ATOM 456 CE1 PHE A 26 -5.133 2.087 -5.739 1.00 0.00 C ATOM 457 CE2 PHE A 26 -4.305 0.016 -4.878 1.00 0.00 C ATOM 458 CZ PHE A 26 -4.679 0.800 -5.953 1.00 0.00 C ATOM 0 H PHE A 26 -5.589 3.013 0.372 1.00 0.00 H new ATOM 0 HA PHE A 26 -6.917 3.173 -2.102 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -4.504 3.340 -1.923 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -4.391 1.711 -1.287 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -5.566 3.597 -4.295 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -4.101 -0.099 -2.757 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -5.426 2.702 -6.577 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -3.946 -0.989 -5.041 1.00 0.00 H new ATOM 0 HZ PHE A 26 -4.617 0.408 -6.957 1.00 0.00 H new ATOM 468 N MET A 27 -6.750 0.176 -0.698 1.00 0.00 N ATOM 469 CA MET A 27 -7.412 -1.119 -0.628 1.00 0.00 C ATOM 470 C MET A 27 -8.909 -0.912 -0.467 1.00 0.00 C ATOM 471 O MET A 27 -9.705 -1.496 -1.196 1.00 0.00 O ATOM 472 CB MET A 27 -6.865 -1.939 0.541 1.00 0.00 C ATOM 473 CG MET A 27 -5.383 -2.248 0.427 1.00 0.00 C ATOM 474 SD MET A 27 -4.748 -3.137 1.861 1.00 0.00 S ATOM 475 CE MET A 27 -3.017 -3.283 1.422 1.00 0.00 C ATOM 0 H MET A 27 -6.018 0.313 -0.001 1.00 0.00 H new ATOM 0 HA MET A 27 -7.218 -1.668 -1.550 1.00 0.00 H new ATOM 0 HB2 MET A 27 -7.044 -1.397 1.469 1.00 0.00 H new ATOM 0 HB3 MET A 27 -7.419 -2.876 0.607 1.00 0.00 H new ATOM 0 HG2 MET A 27 -5.207 -2.841 -0.471 1.00 0.00 H new ATOM 0 HG3 MET A 27 -4.830 -1.317 0.307 1.00 0.00 H new ATOM 0 HE1 MET A 27 -2.610 -4.201 1.845 1.00 0.00 H new ATOM 0 HE2 MET A 27 -2.918 -3.309 0.337 1.00 0.00 H new ATOM 0 HE3 MET A 27 -2.468 -2.428 1.816 1.00 0.00 H new ATOM 485 N GLN A 28 -9.273 -0.046 0.472 1.00 0.00 N ATOM 486 CA GLN A 28 -10.668 0.299 0.721 1.00 0.00 C ATOM 487 C GLN A 28 -11.381 0.690 -0.565 1.00 0.00 C ATOM 488 O GLN A 28 -12.391 0.089 -0.927 1.00 0.00 O ATOM 489 CB GLN A 28 -10.753 1.452 1.717 1.00 0.00 C ATOM 490 CG GLN A 28 -12.155 2.005 1.886 1.00 0.00 C ATOM 491 CD GLN A 28 -12.183 3.233 2.762 1.00 0.00 C ATOM 492 OE1 GLN A 28 -12.082 4.364 2.281 1.00 0.00 O ATOM 493 NE2 GLN A 28 -12.292 3.014 4.056 1.00 0.00 N ATOM 0 H GLN A 28 -8.611 0.436 1.081 1.00 0.00 H new ATOM 0 HA GLN A 28 -11.159 -0.582 1.134 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -10.386 1.112 2.686 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -10.092 2.254 1.389 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -12.567 2.250 0.907 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -12.796 1.237 2.319 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -12.373 2.060 4.407 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -12.295 3.799 4.708 1.00 0.00 H new ATOM 502 N ASP A 29 -10.842 1.692 -1.249 1.00 0.00 N ATOM 503 CA ASP A 29 -11.440 2.196 -2.479 1.00 0.00 C ATOM 504 C ASP A 29 -11.589 1.090 -3.510 1.00 0.00 C ATOM 505 O ASP A 29 -12.644 0.942 -4.109 1.00 0.00 O ATOM 506 CB ASP A 29 -10.610 3.341 -3.068 1.00 0.00 C ATOM 507 CG ASP A 29 -11.260 4.695 -2.860 1.00 0.00 C ATOM 508 OD1 ASP A 29 -12.179 5.046 -3.639 1.00 0.00 O ATOM 509 OD2 ASP A 29 -10.862 5.421 -1.921 1.00 0.00 O ATOM 0 H ASP A 29 -9.987 2.174 -0.971 1.00 0.00 H new ATOM 0 HA ASP A 29 -12.430 2.574 -2.225 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -9.621 3.342 -2.610 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -10.467 3.170 -4.135 1.00 0.00 H new ATOM 514 N VAL A 30 -10.544 0.298 -3.690 1.00 0.00 N ATOM 515 CA VAL A 30 -10.550 -0.758 -4.695 1.00 0.00 C ATOM 516 C VAL A 30 -11.606 -1.831 -4.393 1.00 0.00 C ATOM 517 O VAL A 30 -12.344 -2.246 -5.289 1.00 0.00 O ATOM 518 CB VAL A 30 -9.157 -1.413 -4.828 1.00 0.00 C ATOM 519 CG1 VAL A 30 -9.188 -2.562 -5.819 1.00 0.00 C ATOM 520 CG2 VAL A 30 -8.126 -0.383 -5.258 1.00 0.00 C ATOM 0 H VAL A 30 -9.679 0.365 -3.154 1.00 0.00 H new ATOM 0 HA VAL A 30 -10.808 -0.286 -5.643 1.00 0.00 H new ATOM 0 HB VAL A 30 -8.877 -1.809 -3.852 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -8.195 -3.005 -5.893 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -9.897 -3.317 -5.479 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -9.494 -2.191 -6.797 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -7.150 -0.860 -5.347 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -8.413 0.039 -6.221 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -8.074 0.412 -4.515 1.00 0.00 H new ATOM 530 N VAL A 31 -11.692 -2.260 -3.134 1.00 0.00 N ATOM 531 CA VAL A 31 -12.631 -3.317 -2.749 1.00 0.00 C ATOM 532 C VAL A 31 -14.069 -2.788 -2.695 1.00 0.00 C ATOM 533 O VAL A 31 -15.025 -3.516 -2.963 1.00 0.00 O ATOM 534 CB VAL A 31 -12.284 -3.930 -1.367 1.00 0.00 C ATOM 535 CG1 VAL A 31 -13.090 -5.196 -1.122 1.00 0.00 C ATOM 536 CG2 VAL A 31 -10.796 -4.220 -1.239 1.00 0.00 C ATOM 0 H VAL A 31 -11.127 -1.896 -2.367 1.00 0.00 H new ATOM 0 HA VAL A 31 -12.546 -4.090 -3.513 1.00 0.00 H new ATOM 0 HB VAL A 31 -12.547 -3.193 -0.609 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -12.831 -5.609 -0.147 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -14.154 -4.960 -1.145 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -12.864 -5.927 -1.898 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -10.592 -4.648 -0.258 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -10.495 -4.926 -2.013 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -10.233 -3.294 -1.354 1.00 0.00 H new ATOM 546 N ASN A 32 -14.218 -1.517 -2.342 1.00 0.00 N ATOM 547 CA ASN A 32 -15.542 -0.926 -2.158 1.00 0.00 C ATOM 548 C ASN A 32 -16.098 -0.405 -3.481 1.00 0.00 C ATOM 549 O ASN A 32 -17.310 -0.379 -3.692 1.00 0.00 O ATOM 550 CB ASN A 32 -15.477 0.207 -1.127 1.00 0.00 C ATOM 551 CG ASN A 32 -16.847 0.625 -0.624 1.00 0.00 C ATOM 552 OD1 ASN A 32 -17.776 -0.179 -0.577 1.00 0.00 O ATOM 553 ND2 ASN A 32 -16.976 1.881 -0.232 1.00 0.00 N ATOM 0 H ASN A 32 -13.442 -0.876 -2.177 1.00 0.00 H new ATOM 0 HA ASN A 32 -16.213 -1.702 -1.790 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -14.867 -0.112 -0.282 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -14.980 1.069 -1.572 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -17.871 2.214 0.126 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -16.180 2.517 -0.287 1.00 0.00 H new ATOM 560 N SER A 33 -15.207 0.009 -4.369 1.00 0.00 N ATOM 561 CA SER A 33 -15.600 0.509 -5.677 1.00 0.00 C ATOM 562 C SER A 33 -15.760 -0.650 -6.653 1.00 0.00 C ATOM 563 O SER A 33 -15.286 -1.755 -6.397 1.00 0.00 O ATOM 564 CB SER A 33 -14.552 1.504 -6.194 1.00 0.00 C ATOM 565 OG SER A 33 -14.854 1.970 -7.499 1.00 0.00 O ATOM 0 H SER A 33 -14.200 0.008 -4.206 1.00 0.00 H new ATOM 0 HA SER A 33 -16.557 1.024 -5.589 1.00 0.00 H new ATOM 0 HB2 SER A 33 -14.491 2.352 -5.512 1.00 0.00 H new ATOM 0 HB3 SER A 33 -13.572 1.027 -6.198 1.00 0.00 H new ATOM 0 HG SER A 33 -14.150 1.686 -8.119 1.00 0.00 H new ATOM 571 N ASP A 34 -16.410 -0.388 -7.783 1.00 0.00 N ATOM 572 CA ASP A 34 -16.616 -1.405 -8.812 1.00 0.00 C ATOM 573 C ASP A 34 -15.293 -1.821 -9.443 1.00 0.00 C ATOM 574 O ASP A 34 -15.247 -2.749 -10.249 1.00 0.00 O ATOM 575 CB ASP A 34 -17.574 -0.896 -9.893 1.00 0.00 C ATOM 576 CG ASP A 34 -18.983 -0.702 -9.372 1.00 0.00 C ATOM 577 OD1 ASP A 34 -19.753 -1.685 -9.342 1.00 0.00 O ATOM 578 OD2 ASP A 34 -19.325 0.429 -8.970 1.00 0.00 O ATOM 0 H ASP A 34 -16.805 0.524 -8.011 1.00 0.00 H new ATOM 0 HA ASP A 34 -17.059 -2.277 -8.332 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -17.202 0.050 -10.288 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -17.590 -1.603 -10.722 1.00 0.00 H new ATOM 583 N THR A 35 -14.224 -1.128 -9.057 1.00 0.00 N ATOM 584 CA THR A 35 -12.877 -1.449 -9.498 1.00 0.00 C ATOM 585 C THR A 35 -12.576 -2.933 -9.290 1.00 0.00 C ATOM 586 O THR A 35 -12.175 -3.627 -10.223 1.00 0.00 O ATOM 587 CB THR A 35 -11.853 -0.606 -8.719 1.00 0.00 C ATOM 588 OG1 THR A 35 -12.290 0.758 -8.689 1.00 0.00 O ATOM 589 CG2 THR A 35 -10.468 -0.684 -9.351 1.00 0.00 C ATOM 0 H THR A 35 -14.272 -0.327 -8.428 1.00 0.00 H new ATOM 0 HA THR A 35 -12.805 -1.222 -10.562 1.00 0.00 H new ATOM 0 HB THR A 35 -11.783 -1.003 -7.706 1.00 0.00 H new ATOM 0 HG1 THR A 35 -11.641 1.299 -8.192 1.00 0.00 H new ATOM 0 HG21 THR A 35 -9.770 -0.077 -8.775 1.00 0.00 H new ATOM 0 HG22 THR A 35 -10.128 -1.720 -9.357 1.00 0.00 H new ATOM 0 HG23 THR A 35 -10.514 -0.312 -10.374 1.00 0.00 H new ATOM 597 N PHE A 36 -12.784 -3.414 -8.069 1.00 0.00 N ATOM 598 CA PHE A 36 -12.576 -4.824 -7.763 1.00 0.00 C ATOM 599 C PHE A 36 -13.616 -5.349 -6.778 1.00 0.00 C ATOM 600 O PHE A 36 -13.383 -6.353 -6.114 1.00 0.00 O ATOM 601 CB PHE A 36 -11.171 -5.060 -7.200 1.00 0.00 C ATOM 602 CG PHE A 36 -10.125 -5.320 -8.250 1.00 0.00 C ATOM 603 CD1 PHE A 36 -9.887 -6.610 -8.698 1.00 0.00 C ATOM 604 CD2 PHE A 36 -9.377 -4.282 -8.784 1.00 0.00 C ATOM 605 CE1 PHE A 36 -8.926 -6.860 -9.657 1.00 0.00 C ATOM 606 CE2 PHE A 36 -8.414 -4.526 -9.745 1.00 0.00 C ATOM 607 CZ PHE A 36 -8.188 -5.817 -10.182 1.00 0.00 C ATOM 0 H PHE A 36 -13.095 -2.850 -7.278 1.00 0.00 H new ATOM 0 HA PHE A 36 -12.684 -5.371 -8.700 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -10.875 -4.190 -6.615 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -11.203 -5.908 -6.516 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -10.461 -7.430 -8.292 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -9.549 -3.271 -8.445 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -8.751 -7.870 -9.997 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -7.839 -3.708 -10.154 1.00 0.00 H new ATOM 0 HZ PHE A 36 -7.436 -6.010 -10.933 1.00 0.00 H new ATOM 617 N LYS A 37 -14.777 -4.702 -6.710 1.00 0.00 N ATOM 618 CA LYS A 37 -15.846 -5.165 -5.822 1.00 0.00 C ATOM 619 C LYS A 37 -16.368 -6.533 -6.280 1.00 0.00 C ATOM 620 O LYS A 37 -17.113 -7.203 -5.565 1.00 0.00 O ATOM 621 CB LYS A 37 -17.000 -4.152 -5.755 1.00 0.00 C ATOM 622 CG LYS A 37 -17.967 -4.413 -4.605 1.00 0.00 C ATOM 623 CD LYS A 37 -19.009 -3.309 -4.442 1.00 0.00 C ATOM 624 CE LYS A 37 -20.105 -3.375 -5.500 1.00 0.00 C ATOM 625 NZ LYS A 37 -19.679 -2.791 -6.797 1.00 0.00 N ATOM 0 H LYS A 37 -15.002 -3.867 -7.250 1.00 0.00 H new ATOM 0 HA LYS A 37 -15.426 -5.262 -4.821 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -16.587 -3.148 -5.653 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -17.550 -4.176 -6.696 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -18.475 -5.363 -4.773 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -17.403 -4.512 -3.678 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -19.460 -3.383 -3.452 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -18.516 -2.338 -4.495 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -20.397 -4.414 -5.652 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -20.987 -2.845 -5.139 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -20.441 -2.193 -7.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -18.825 -2.215 -6.655 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -19.472 -3.556 -7.471 1.00 0.00 H new ATOM 639 N GLY A 38 -15.975 -6.936 -7.489 1.00 0.00 N ATOM 640 CA GLY A 38 -16.286 -8.269 -7.969 1.00 0.00 C ATOM 641 C GLY A 38 -15.503 -9.333 -7.222 1.00 0.00 C ATOM 642 O GLY A 38 -15.901 -10.501 -7.179 1.00 0.00 O ATOM 0 H GLY A 38 -15.446 -6.359 -8.143 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -17.354 -8.456 -7.856 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -16.062 -8.333 -9.034 1.00 0.00 H new ATOM 646 N GLN A 39 -14.394 -8.925 -6.628 1.00 0.00 N ATOM 647 CA GLN A 39 -13.554 -9.818 -5.848 1.00 0.00 C ATOM 648 C GLN A 39 -13.523 -9.363 -4.391 1.00 0.00 C ATOM 649 O GLN A 39 -12.943 -8.327 -4.074 1.00 0.00 O ATOM 650 CB GLN A 39 -12.140 -9.857 -6.432 1.00 0.00 C ATOM 651 CG GLN A 39 -11.203 -10.810 -5.709 1.00 0.00 C ATOM 652 CD GLN A 39 -11.719 -12.237 -5.692 1.00 0.00 C ATOM 653 OE1 GLN A 39 -12.420 -12.671 -6.605 1.00 0.00 O ATOM 654 NE2 GLN A 39 -11.377 -12.974 -4.646 1.00 0.00 N ATOM 0 H GLN A 39 -14.051 -7.966 -6.673 1.00 0.00 H new ATOM 0 HA GLN A 39 -13.970 -10.825 -5.889 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -12.198 -10.146 -7.481 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -11.717 -8.853 -6.401 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -10.225 -10.787 -6.190 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -11.062 -10.467 -4.684 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -10.794 -12.576 -3.910 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -11.697 -13.940 -4.576 1.00 0.00 H new ATOM 663 N PRO A 40 -14.153 -10.133 -3.494 1.00 0.00 N ATOM 664 CA PRO A 40 -14.285 -9.761 -2.077 1.00 0.00 C ATOM 665 C PRO A 40 -12.942 -9.535 -1.386 1.00 0.00 C ATOM 666 O PRO A 40 -12.772 -8.560 -0.659 1.00 0.00 O ATOM 667 CB PRO A 40 -15.012 -10.960 -1.451 1.00 0.00 C ATOM 668 CG PRO A 40 -14.858 -12.073 -2.433 1.00 0.00 C ATOM 669 CD PRO A 40 -14.793 -11.423 -3.781 1.00 0.00 C ATOM 0 HA PRO A 40 -14.815 -8.815 -1.967 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -14.577 -11.224 -0.487 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -16.064 -10.734 -1.275 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -13.954 -12.649 -2.233 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -15.697 -12.766 -2.373 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -14.210 -12.015 -4.487 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -15.784 -11.294 -4.215 1.00 0.00 H new ATOM 677 N ILE A 41 -11.997 -10.443 -1.605 1.00 0.00 N ATOM 678 CA ILE A 41 -10.684 -10.350 -0.975 1.00 0.00 C ATOM 679 C ILE A 41 -9.594 -10.697 -1.985 1.00 0.00 C ATOM 680 O ILE A 41 -9.828 -11.473 -2.916 1.00 0.00 O ATOM 681 CB ILE A 41 -10.574 -11.287 0.252 1.00 0.00 C ATOM 682 CG1 ILE A 41 -11.763 -11.084 1.193 1.00 0.00 C ATOM 683 CG2 ILE A 41 -9.271 -11.042 1.001 1.00 0.00 C ATOM 684 CD1 ILE A 41 -11.653 -11.859 2.484 1.00 0.00 C ATOM 0 H ILE A 41 -12.115 -11.252 -2.214 1.00 0.00 H new ATOM 0 HA ILE A 41 -10.553 -9.324 -0.631 1.00 0.00 H new ATOM 0 HB ILE A 41 -10.582 -12.316 -0.108 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -11.856 -10.023 1.423 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -12.677 -11.380 0.678 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -9.214 -11.711 1.860 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -8.428 -11.232 0.336 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -9.237 -10.008 1.344 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -12.531 -11.666 3.100 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -11.591 -12.925 2.264 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -10.757 -11.547 3.021 1.00 0.00 H new ATOM 696 N PHE A 42 -8.407 -10.134 -1.799 1.00 0.00 N ATOM 697 CA PHE A 42 -7.326 -10.289 -2.761 1.00 0.00 C ATOM 698 C PHE A 42 -6.387 -11.431 -2.388 1.00 0.00 C ATOM 699 O PHE A 42 -6.579 -12.123 -1.390 1.00 0.00 O ATOM 700 CB PHE A 42 -6.524 -8.993 -2.880 1.00 0.00 C ATOM 701 CG PHE A 42 -7.297 -7.861 -3.487 1.00 0.00 C ATOM 702 CD1 PHE A 42 -7.590 -7.857 -4.841 1.00 0.00 C ATOM 703 CD2 PHE A 42 -7.731 -6.802 -2.706 1.00 0.00 C ATOM 704 CE1 PHE A 42 -8.300 -6.816 -5.405 1.00 0.00 C ATOM 705 CE2 PHE A 42 -8.440 -5.759 -3.266 1.00 0.00 C ATOM 706 CZ PHE A 42 -8.728 -5.768 -4.616 1.00 0.00 C ATOM 0 H PHE A 42 -8.169 -9.564 -0.987 1.00 0.00 H new ATOM 0 HA PHE A 42 -7.787 -10.527 -3.720 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -6.180 -8.697 -1.889 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -5.636 -9.180 -3.483 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -7.260 -8.677 -5.462 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -7.512 -6.793 -1.648 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -8.520 -6.822 -6.462 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -8.769 -4.936 -2.649 1.00 0.00 H new ATOM 0 HZ PHE A 42 -9.288 -4.955 -5.054 1.00 0.00 H new ATOM 716 N ASP A 43 -5.377 -11.614 -3.222 1.00 0.00 N ATOM 717 CA ASP A 43 -4.362 -12.636 -3.019 1.00 0.00 C ATOM 718 C ASP A 43 -3.157 -12.033 -2.310 1.00 0.00 C ATOM 719 O ASP A 43 -3.020 -10.814 -2.244 1.00 0.00 O ATOM 720 CB ASP A 43 -3.901 -13.195 -4.372 1.00 0.00 C ATOM 721 CG ASP A 43 -5.042 -13.462 -5.333 1.00 0.00 C ATOM 722 OD1 ASP A 43 -5.505 -12.503 -5.995 1.00 0.00 O ATOM 723 OD2 ASP A 43 -5.470 -14.626 -5.443 1.00 0.00 O ATOM 0 H ASP A 43 -5.237 -11.055 -4.064 1.00 0.00 H new ATOM 0 HA ASP A 43 -4.791 -13.435 -2.414 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -3.207 -12.491 -4.830 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -3.351 -14.121 -4.206 1.00 0.00 H new ATOM 728 N HIS A 44 -2.274 -12.882 -1.802 1.00 0.00 N ATOM 729 CA HIS A 44 -0.993 -12.421 -1.271 1.00 0.00 C ATOM 730 C HIS A 44 -0.097 -11.993 -2.430 1.00 0.00 C ATOM 731 O HIS A 44 0.739 -11.094 -2.301 1.00 0.00 O ATOM 732 CB HIS A 44 -0.312 -13.513 -0.435 1.00 0.00 C ATOM 733 CG HIS A 44 -0.884 -13.669 0.945 1.00 0.00 C ATOM 734 ND1 HIS A 44 -0.113 -13.609 2.087 1.00 0.00 N ATOM 735 CD2 HIS A 44 -2.153 -13.888 1.365 1.00 0.00 C ATOM 736 CE1 HIS A 44 -0.883 -13.786 3.147 1.00 0.00 C ATOM 737 NE2 HIS A 44 -2.124 -13.959 2.735 1.00 0.00 N ATOM 0 H HIS A 44 -2.418 -13.890 -1.745 1.00 0.00 H new ATOM 0 HA HIS A 44 -1.169 -11.570 -0.612 1.00 0.00 H new ATOM 0 HB2 HIS A 44 -0.394 -14.464 -0.961 1.00 0.00 H new ATOM 0 HB3 HIS A 44 0.751 -13.285 -0.353 1.00 0.00 H new ATOM 0 HD1 HIS A 44 0.895 -13.452 2.110 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -3.026 -13.988 0.738 1.00 0.00 H new ATOM 0 HE1 HIS A 44 -0.552 -13.789 4.175 1.00 0.00 H new ATOM 746 N ALA A 45 -0.304 -12.632 -3.577 1.00 0.00 N ATOM 747 CA ALA A 45 0.352 -12.225 -4.811 1.00 0.00 C ATOM 748 C ALA A 45 -0.184 -10.869 -5.248 1.00 0.00 C ATOM 749 O ALA A 45 0.501 -10.088 -5.905 1.00 0.00 O ATOM 750 CB ALA A 45 0.133 -13.266 -5.899 1.00 0.00 C ATOM 0 H ALA A 45 -0.923 -13.436 -3.676 1.00 0.00 H new ATOM 0 HA ALA A 45 1.425 -12.142 -4.636 1.00 0.00 H new ATOM 0 HB1 ALA A 45 0.630 -12.946 -6.815 1.00 0.00 H new ATOM 0 HB2 ALA A 45 0.547 -14.222 -5.577 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -0.935 -13.378 -6.086 1.00 0.00 H new ATOM 756 N HIS A 46 -1.418 -10.588 -4.852 1.00 0.00 N ATOM 757 CA HIS A 46 -2.029 -9.299 -5.125 1.00 0.00 C ATOM 758 C HIS A 46 -1.527 -8.262 -4.133 1.00 0.00 C ATOM 759 O HIS A 46 -1.588 -7.063 -4.398 1.00 0.00 O ATOM 760 CB HIS A 46 -3.553 -9.393 -5.074 1.00 0.00 C ATOM 761 CG HIS A 46 -4.203 -9.133 -6.395 1.00 0.00 C ATOM 762 ND1 HIS A 46 -4.956 -10.068 -7.067 1.00 0.00 N ATOM 763 CD2 HIS A 46 -4.192 -8.031 -7.178 1.00 0.00 C ATOM 764 CE1 HIS A 46 -5.377 -9.550 -8.208 1.00 0.00 C ATOM 765 NE2 HIS A 46 -4.926 -8.312 -8.301 1.00 0.00 N ATOM 0 H HIS A 46 -2.014 -11.238 -4.340 1.00 0.00 H new ATOM 0 HA HIS A 46 -1.745 -8.992 -6.131 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -3.838 -10.386 -4.725 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -3.931 -8.678 -4.343 1.00 0.00 H new ATOM 0 HD1 HIS A 46 -5.158 -11.012 -6.737 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -3.695 -7.098 -6.958 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -5.988 -10.055 -8.942 1.00 0.00 H new ATOM 774 N THR A 47 -1.038 -8.731 -2.989 1.00 0.00 N ATOM 775 CA THR A 47 -0.374 -7.863 -2.033 1.00 0.00 C ATOM 776 C THR A 47 0.845 -7.229 -2.677 1.00 0.00 C ATOM 777 O THR A 47 0.929 -6.010 -2.799 1.00 0.00 O ATOM 778 CB THR A 47 0.074 -8.629 -0.773 1.00 0.00 C ATOM 779 OG1 THR A 47 -1.059 -9.200 -0.110 1.00 0.00 O ATOM 780 CG2 THR A 47 0.836 -7.710 0.177 1.00 0.00 C ATOM 0 H THR A 47 -1.091 -9.709 -2.705 1.00 0.00 H new ATOM 0 HA THR A 47 -1.092 -7.099 -1.734 1.00 0.00 H new ATOM 0 HB THR A 47 0.743 -9.433 -1.081 1.00 0.00 H new ATOM 0 HG1 THR A 47 -0.761 -9.685 0.688 1.00 0.00 H new ATOM 0 HG21 THR A 47 1.142 -8.272 1.059 1.00 0.00 H new ATOM 0 HG22 THR A 47 1.719 -7.317 -0.327 1.00 0.00 H new ATOM 0 HG23 THR A 47 0.192 -6.884 0.479 1.00 0.00 H new ATOM 788 N ARG A 48 1.781 -8.070 -3.112 1.00 0.00 N ATOM 789 CA ARG A 48 2.991 -7.580 -3.759 1.00 0.00 C ATOM 790 C ARG A 48 2.645 -6.796 -5.022 1.00 0.00 C ATOM 791 O ARG A 48 3.331 -5.841 -5.372 1.00 0.00 O ATOM 792 CB ARG A 48 3.948 -8.730 -4.086 1.00 0.00 C ATOM 793 CG ARG A 48 3.379 -9.765 -5.041 1.00 0.00 C ATOM 794 CD ARG A 48 4.368 -10.887 -5.288 1.00 0.00 C ATOM 795 NE ARG A 48 3.839 -11.916 -6.179 1.00 0.00 N ATOM 796 CZ ARG A 48 4.113 -13.213 -6.056 1.00 0.00 C ATOM 797 NH1 ARG A 48 4.853 -13.643 -5.040 1.00 0.00 N ATOM 798 NH2 ARG A 48 3.633 -14.081 -6.936 1.00 0.00 N ATOM 0 H ARG A 48 1.724 -9.085 -3.028 1.00 0.00 H new ATOM 0 HA ARG A 48 3.496 -6.911 -3.062 1.00 0.00 H new ATOM 0 HB2 ARG A 48 4.860 -8.317 -4.518 1.00 0.00 H new ATOM 0 HB3 ARG A 48 4.231 -9.226 -3.158 1.00 0.00 H new ATOM 0 HG2 ARG A 48 2.456 -10.174 -4.630 1.00 0.00 H new ATOM 0 HG3 ARG A 48 3.122 -9.288 -5.987 1.00 0.00 H new ATOM 0 HD2 ARG A 48 5.281 -10.474 -5.718 1.00 0.00 H new ATOM 0 HD3 ARG A 48 4.641 -11.342 -4.336 1.00 0.00 H new ATOM 0 HE ARG A 48 3.224 -11.624 -6.939 1.00 0.00 H new ATOM 0 HH11 ARG A 48 5.212 -12.979 -4.353 1.00 0.00 H new ATOM 0 HH12 ARG A 48 5.063 -14.637 -4.946 1.00 0.00 H new ATOM 0 HH21 ARG A 48 3.053 -13.755 -7.709 1.00 0.00 H new ATOM 0 HH22 ARG A 48 3.844 -15.074 -6.840 1.00 0.00 H new ATOM 812 N GLU A 49 1.565 -7.192 -5.688 1.00 0.00 N ATOM 813 CA GLU A 49 1.096 -6.485 -6.871 1.00 0.00 C ATOM 814 C GLU A 49 0.727 -5.045 -6.515 1.00 0.00 C ATOM 815 O GLU A 49 1.269 -4.099 -7.080 1.00 0.00 O ATOM 816 CB GLU A 49 -0.112 -7.207 -7.475 1.00 0.00 C ATOM 817 CG GLU A 49 -0.556 -6.658 -8.823 1.00 0.00 C ATOM 818 CD GLU A 49 -1.795 -7.354 -9.354 1.00 0.00 C ATOM 819 OE1 GLU A 49 -1.783 -8.599 -9.460 1.00 0.00 O ATOM 820 OE2 GLU A 49 -2.794 -6.661 -9.644 1.00 0.00 O ATOM 0 H GLU A 49 0.999 -7.999 -5.427 1.00 0.00 H new ATOM 0 HA GLU A 49 1.898 -6.468 -7.609 1.00 0.00 H new ATOM 0 HB2 GLU A 49 0.129 -8.264 -7.587 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -0.946 -7.143 -6.776 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -0.755 -5.590 -8.729 1.00 0.00 H new ATOM 0 HG3 GLU A 49 0.256 -6.769 -9.542 1.00 0.00 H new ATOM 827 N PHE A 50 -0.174 -4.890 -5.552 1.00 0.00 N ATOM 828 CA PHE A 50 -0.656 -3.571 -5.148 1.00 0.00 C ATOM 829 C PHE A 50 0.422 -2.764 -4.431 1.00 0.00 C ATOM 830 O PHE A 50 0.675 -1.610 -4.777 1.00 0.00 O ATOM 831 CB PHE A 50 -1.887 -3.706 -4.243 1.00 0.00 C ATOM 832 CG PHE A 50 -3.185 -3.867 -4.987 1.00 0.00 C ATOM 833 CD1 PHE A 50 -3.215 -4.387 -6.272 1.00 0.00 C ATOM 834 CD2 PHE A 50 -4.377 -3.483 -4.398 1.00 0.00 C ATOM 835 CE1 PHE A 50 -4.410 -4.520 -6.953 1.00 0.00 C ATOM 836 CE2 PHE A 50 -5.574 -3.612 -5.074 1.00 0.00 C ATOM 837 CZ PHE A 50 -5.591 -4.132 -6.353 1.00 0.00 C ATOM 0 H PHE A 50 -0.588 -5.664 -5.033 1.00 0.00 H new ATOM 0 HA PHE A 50 -0.927 -3.035 -6.058 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -1.749 -4.565 -3.586 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -1.954 -2.825 -3.605 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -2.294 -4.692 -6.746 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -4.371 -3.077 -3.397 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -4.420 -4.927 -7.953 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -6.496 -3.306 -4.603 1.00 0.00 H new ATOM 0 HZ PHE A 50 -6.526 -4.235 -6.883 1.00 0.00 H new ATOM 847 N ILE A 51 1.057 -3.376 -3.438 1.00 0.00 N ATOM 848 CA ILE A 51 2.016 -2.672 -2.596 1.00 0.00 C ATOM 849 C ILE A 51 3.211 -2.165 -3.407 1.00 0.00 C ATOM 850 O ILE A 51 3.586 -0.992 -3.306 1.00 0.00 O ATOM 851 CB ILE A 51 2.518 -3.556 -1.432 1.00 0.00 C ATOM 852 CG1 ILE A 51 1.350 -3.963 -0.523 1.00 0.00 C ATOM 853 CG2 ILE A 51 3.581 -2.822 -0.626 1.00 0.00 C ATOM 854 CD1 ILE A 51 0.614 -2.788 0.091 1.00 0.00 C ATOM 0 H ILE A 51 0.925 -4.358 -3.197 1.00 0.00 H new ATOM 0 HA ILE A 51 1.487 -1.816 -2.177 1.00 0.00 H new ATOM 0 HB ILE A 51 2.961 -4.458 -1.853 1.00 0.00 H new ATOM 0 HG12 ILE A 51 0.644 -4.561 -1.100 1.00 0.00 H new ATOM 0 HG13 ILE A 51 1.729 -4.600 0.276 1.00 0.00 H new ATOM 0 HG21 ILE A 51 3.923 -3.459 0.190 1.00 0.00 H new ATOM 0 HG22 ILE A 51 4.423 -2.577 -1.273 1.00 0.00 H new ATOM 0 HG23 ILE A 51 3.158 -1.904 -0.217 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -0.197 -3.155 0.720 1.00 0.00 H new ATOM 0 HD12 ILE A 51 1.305 -2.202 0.696 1.00 0.00 H new ATOM 0 HD13 ILE A 51 0.204 -2.161 -0.701 1.00 0.00 H new ATOM 866 N GLN A 52 3.789 -3.038 -4.225 1.00 0.00 N ATOM 867 CA GLN A 52 4.981 -2.687 -4.985 1.00 0.00 C ATOM 868 C GLN A 52 4.661 -1.668 -6.073 1.00 0.00 C ATOM 869 O GLN A 52 5.404 -0.709 -6.260 1.00 0.00 O ATOM 870 CB GLN A 52 5.628 -3.934 -5.595 1.00 0.00 C ATOM 871 CG GLN A 52 6.917 -3.651 -6.351 1.00 0.00 C ATOM 872 CD GLN A 52 7.970 -2.977 -5.489 1.00 0.00 C ATOM 873 OE1 GLN A 52 8.026 -3.179 -4.278 1.00 0.00 O ATOM 874 NE2 GLN A 52 8.805 -2.161 -6.112 1.00 0.00 N ATOM 0 H GLN A 52 3.453 -3.989 -4.378 1.00 0.00 H new ATOM 0 HA GLN A 52 5.691 -2.234 -4.293 1.00 0.00 H new ATOM 0 HB2 GLN A 52 5.834 -4.650 -4.800 1.00 0.00 H new ATOM 0 HB3 GLN A 52 4.917 -4.406 -6.273 1.00 0.00 H new ATOM 0 HG2 GLN A 52 7.317 -4.587 -6.740 1.00 0.00 H new ATOM 0 HG3 GLN A 52 6.697 -3.017 -7.210 1.00 0.00 H new ATOM 0 HE21 GLN A 52 8.725 -2.021 -7.119 1.00 0.00 H new ATOM 0 HE22 GLN A 52 9.529 -1.672 -5.585 1.00 0.00 H new ATOM 883 N SER A 53 3.545 -1.857 -6.772 1.00 0.00 N ATOM 884 CA SER A 53 3.147 -0.926 -7.824 1.00 0.00 C ATOM 885 C SER A 53 2.925 0.475 -7.258 1.00 0.00 C ATOM 886 O SER A 53 3.199 1.475 -7.925 1.00 0.00 O ATOM 887 CB SER A 53 1.885 -1.417 -8.528 1.00 0.00 C ATOM 888 OG SER A 53 2.102 -2.679 -9.138 1.00 0.00 O ATOM 0 H SER A 53 2.905 -2.639 -6.631 1.00 0.00 H new ATOM 0 HA SER A 53 3.956 -0.877 -8.553 1.00 0.00 H new ATOM 0 HB2 SER A 53 1.069 -1.492 -7.809 1.00 0.00 H new ATOM 0 HB3 SER A 53 1.580 -0.692 -9.282 1.00 0.00 H new ATOM 0 HG SER A 53 2.159 -3.371 -8.446 1.00 0.00 H new ATOM 894 N PHE A 54 2.440 0.539 -6.020 1.00 0.00 N ATOM 895 CA PHE A 54 2.242 1.815 -5.348 1.00 0.00 C ATOM 896 C PHE A 54 3.593 2.484 -5.103 1.00 0.00 C ATOM 897 O PHE A 54 3.725 3.701 -5.223 1.00 0.00 O ATOM 898 CB PHE A 54 1.495 1.609 -4.025 1.00 0.00 C ATOM 899 CG PHE A 54 0.830 2.853 -3.498 1.00 0.00 C ATOM 900 CD1 PHE A 54 1.526 3.748 -2.700 1.00 0.00 C ATOM 901 CD2 PHE A 54 -0.494 3.123 -3.800 1.00 0.00 C ATOM 902 CE1 PHE A 54 0.913 4.887 -2.214 1.00 0.00 C ATOM 903 CE2 PHE A 54 -1.112 4.261 -3.317 1.00 0.00 C ATOM 904 CZ PHE A 54 -0.407 5.144 -2.524 1.00 0.00 C ATOM 0 H PHE A 54 2.179 -0.276 -5.466 1.00 0.00 H new ATOM 0 HA PHE A 54 1.639 2.463 -5.983 1.00 0.00 H new ATOM 0 HB2 PHE A 54 0.739 0.836 -4.163 1.00 0.00 H new ATOM 0 HB3 PHE A 54 2.196 1.239 -3.277 1.00 0.00 H new ATOM 0 HD1 PHE A 54 2.560 3.553 -2.455 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -1.050 2.436 -4.420 1.00 0.00 H new ATOM 0 HE1 PHE A 54 1.466 5.575 -1.592 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -2.146 4.459 -3.560 1.00 0.00 H new ATOM 0 HZ PHE A 54 -0.888 6.035 -2.147 1.00 0.00 H new ATOM 914 N ILE A 55 4.596 1.671 -4.780 1.00 0.00 N ATOM 915 CA ILE A 55 5.963 2.157 -4.602 1.00 0.00 C ATOM 916 C ILE A 55 6.552 2.585 -5.945 1.00 0.00 C ATOM 917 O ILE A 55 7.199 3.626 -6.058 1.00 0.00 O ATOM 918 CB ILE A 55 6.870 1.071 -3.971 1.00 0.00 C ATOM 919 CG1 ILE A 55 6.298 0.616 -2.626 1.00 0.00 C ATOM 920 CG2 ILE A 55 8.294 1.587 -3.795 1.00 0.00 C ATOM 921 CD1 ILE A 55 7.075 -0.511 -1.982 1.00 0.00 C ATOM 0 H ILE A 55 4.487 0.667 -4.635 1.00 0.00 H new ATOM 0 HA ILE A 55 5.922 3.013 -3.928 1.00 0.00 H new ATOM 0 HB ILE A 55 6.899 0.216 -4.647 1.00 0.00 H new ATOM 0 HG12 ILE A 55 6.277 1.466 -1.944 1.00 0.00 H new ATOM 0 HG13 ILE A 55 5.266 0.297 -2.770 1.00 0.00 H new ATOM 0 HG21 ILE A 55 8.911 0.807 -3.350 1.00 0.00 H new ATOM 0 HG22 ILE A 55 8.703 1.864 -4.767 1.00 0.00 H new ATOM 0 HG23 ILE A 55 8.287 2.460 -3.142 1.00 0.00 H new ATOM 0 HD11 ILE A 55 6.610 -0.778 -1.033 1.00 0.00 H new ATOM 0 HD12 ILE A 55 7.075 -1.378 -2.643 1.00 0.00 H new ATOM 0 HD13 ILE A 55 8.102 -0.190 -1.805 1.00 0.00 H new ATOM 933 N GLU A 56 6.302 1.778 -6.972 1.00 0.00 N ATOM 934 CA GLU A 56 6.812 2.050 -8.312 1.00 0.00 C ATOM 935 C GLU A 56 6.201 3.319 -8.899 1.00 0.00 C ATOM 936 O GLU A 56 6.743 3.890 -9.846 1.00 0.00 O ATOM 937 CB GLU A 56 6.545 0.869 -9.246 1.00 0.00 C ATOM 938 CG GLU A 56 7.266 -0.405 -8.844 1.00 0.00 C ATOM 939 CD GLU A 56 7.088 -1.514 -9.858 1.00 0.00 C ATOM 940 OE1 GLU A 56 6.038 -2.180 -9.840 1.00 0.00 O ATOM 941 OE2 GLU A 56 8.003 -1.718 -10.684 1.00 0.00 O ATOM 0 H GLU A 56 5.746 0.926 -6.901 1.00 0.00 H new ATOM 0 HA GLU A 56 7.888 2.198 -8.222 1.00 0.00 H new ATOM 0 HB2 GLU A 56 5.473 0.675 -9.274 1.00 0.00 H new ATOM 0 HB3 GLU A 56 6.846 1.142 -10.257 1.00 0.00 H new ATOM 0 HG2 GLU A 56 8.329 -0.195 -8.723 1.00 0.00 H new ATOM 0 HG3 GLU A 56 6.894 -0.739 -7.875 1.00 0.00 H new ATOM 948 N ARG A 57 5.077 3.761 -8.343 1.00 0.00 N ATOM 949 CA ARG A 57 4.437 4.985 -8.810 1.00 0.00 C ATOM 950 C ARG A 57 5.344 6.196 -8.587 1.00 0.00 C ATOM 951 O ARG A 57 5.221 7.207 -9.276 1.00 0.00 O ATOM 952 CB ARG A 57 3.096 5.221 -8.111 1.00 0.00 C ATOM 953 CG ARG A 57 2.425 6.508 -8.567 1.00 0.00 C ATOM 954 CD ARG A 57 1.381 6.997 -7.584 1.00 0.00 C ATOM 955 NE ARG A 57 1.382 8.456 -7.503 1.00 0.00 N ATOM 956 CZ ARG A 57 0.739 9.155 -6.571 1.00 0.00 C ATOM 957 NH1 ARG A 57 -0.117 8.549 -5.751 1.00 0.00 N ATOM 958 NH2 ARG A 57 0.927 10.466 -6.486 1.00 0.00 N ATOM 0 H ARG A 57 4.594 3.294 -7.575 1.00 0.00 H new ATOM 0 HA ARG A 57 4.257 4.862 -9.878 1.00 0.00 H new ATOM 0 HB2 ARG A 57 2.433 4.379 -8.308 1.00 0.00 H new ATOM 0 HB3 ARG A 57 3.252 5.258 -7.033 1.00 0.00 H new ATOM 0 HG2 ARG A 57 3.182 7.280 -8.703 1.00 0.00 H new ATOM 0 HG3 ARG A 57 1.957 6.346 -9.538 1.00 0.00 H new ATOM 0 HD2 ARG A 57 0.395 6.647 -7.890 1.00 0.00 H new ATOM 0 HD3 ARG A 57 1.577 6.574 -6.599 1.00 0.00 H new ATOM 0 HE ARG A 57 1.910 8.972 -8.207 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -0.282 7.546 -5.836 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -0.608 9.088 -5.038 1.00 0.00 H new ATOM 0 HH21 ARG A 57 1.562 10.933 -7.133 1.00 0.00 H new ATOM 0 HH22 ARG A 57 0.437 11.006 -5.773 1.00 0.00 H new ATOM 972 N ASP A 58 6.265 6.089 -7.632 1.00 0.00 N ATOM 973 CA ASP A 58 7.179 7.192 -7.336 1.00 0.00 C ATOM 974 C ASP A 58 8.065 7.476 -8.546 1.00 0.00 C ATOM 975 O ASP A 58 8.585 8.577 -8.711 1.00 0.00 O ATOM 976 CB ASP A 58 8.043 6.874 -6.110 1.00 0.00 C ATOM 977 CG ASP A 58 8.588 8.127 -5.445 1.00 0.00 C ATOM 978 OD1 ASP A 58 7.974 9.205 -5.605 1.00 0.00 O ATOM 979 OD2 ASP A 58 9.601 8.034 -4.721 1.00 0.00 O ATOM 0 H ASP A 58 6.399 5.259 -7.054 1.00 0.00 H new ATOM 0 HA ASP A 58 6.585 8.079 -7.113 1.00 0.00 H new ATOM 0 HB2 ASP A 58 7.451 6.311 -5.388 1.00 0.00 H new ATOM 0 HB3 ASP A 58 8.873 6.235 -6.410 1.00 0.00 H new ATOM 984 N ASP A 59 8.206 6.477 -9.413 1.00 0.00 N ATOM 985 CA ASP A 59 8.964 6.632 -10.647 1.00 0.00 C ATOM 986 C ASP A 59 8.200 7.528 -11.621 1.00 0.00 C ATOM 987 O ASP A 59 8.792 8.180 -12.479 1.00 0.00 O ATOM 988 CB ASP A 59 9.235 5.266 -11.281 1.00 0.00 C ATOM 989 CG ASP A 59 10.255 5.328 -12.403 1.00 0.00 C ATOM 990 OD1 ASP A 59 11.316 5.957 -12.212 1.00 0.00 O ATOM 991 OD2 ASP A 59 10.021 4.713 -13.463 1.00 0.00 O ATOM 0 H ASP A 59 7.803 5.549 -9.281 1.00 0.00 H new ATOM 0 HA ASP A 59 9.921 7.100 -10.415 1.00 0.00 H new ATOM 0 HB2 ASP A 59 9.589 4.578 -10.513 1.00 0.00 H new ATOM 0 HB3 ASP A 59 8.301 4.859 -11.668 1.00 0.00 H new ATOM 996 N THR A 60 6.880 7.565 -11.462 1.00 0.00 N ATOM 997 CA THR A 60 6.029 8.437 -12.262 1.00 0.00 C ATOM 998 C THR A 60 6.100 9.867 -11.737 1.00 0.00 C ATOM 999 O THR A 60 6.083 10.828 -12.507 1.00 0.00 O ATOM 1000 CB THR A 60 4.561 7.960 -12.249 1.00 0.00 C ATOM 1001 OG1 THR A 60 4.489 6.574 -12.609 1.00 0.00 O ATOM 1002 CG2 THR A 60 3.711 8.777 -13.212 1.00 0.00 C ATOM 0 H THR A 60 6.375 6.997 -10.782 1.00 0.00 H new ATOM 0 HA THR A 60 6.394 8.402 -13.288 1.00 0.00 H new ATOM 0 HB THR A 60 4.173 8.097 -11.239 1.00 0.00 H new ATOM 0 HG1 THR A 60 3.554 6.281 -12.596 1.00 0.00 H new ATOM 0 HG21 THR A 60 2.682 8.419 -13.182 1.00 0.00 H new ATOM 0 HG22 THR A 60 3.739 9.827 -12.921 1.00 0.00 H new ATOM 0 HG23 THR A 60 4.103 8.671 -14.223 1.00 0.00 H new ATOM 1010 N GLU A 61 6.202 10.001 -10.422 1.00 0.00 N ATOM 1011 CA GLU A 61 6.359 11.308 -9.806 1.00 0.00 C ATOM 1012 C GLU A 61 7.745 11.843 -10.150 1.00 0.00 C ATOM 1013 O GLU A 61 7.942 13.042 -10.358 1.00 0.00 O ATOM 1014 CB GLU A 61 6.186 11.211 -8.287 1.00 0.00 C ATOM 1015 CG GLU A 61 5.018 10.335 -7.843 1.00 0.00 C ATOM 1016 CD GLU A 61 3.676 10.781 -8.394 1.00 0.00 C ATOM 1017 OE1 GLU A 61 3.023 11.646 -7.771 1.00 0.00 O ATOM 1018 OE2 GLU A 61 3.252 10.250 -9.439 1.00 0.00 O ATOM 0 H GLU A 61 6.179 9.222 -9.764 1.00 0.00 H new ATOM 0 HA GLU A 61 5.596 11.987 -10.186 1.00 0.00 H new ATOM 0 HB2 GLU A 61 7.105 10.818 -7.853 1.00 0.00 H new ATOM 0 HB3 GLU A 61 6.046 12.214 -7.884 1.00 0.00 H new ATOM 0 HG2 GLU A 61 5.206 9.308 -8.156 1.00 0.00 H new ATOM 0 HG3 GLU A 61 4.971 10.332 -6.754 1.00 0.00 H new ATOM 1025 N LEU A 62 8.701 10.921 -10.218 1.00 0.00 N ATOM 1026 CA LEU A 62 10.060 11.222 -10.648 1.00 0.00 C ATOM 1027 C LEU A 62 10.090 11.545 -12.139 1.00 0.00 C ATOM 1028 O LEU A 62 10.950 12.289 -12.606 1.00 0.00 O ATOM 1029 CB LEU A 62 10.970 10.025 -10.351 1.00 0.00 C ATOM 1030 CG LEU A 62 12.437 10.175 -10.763 1.00 0.00 C ATOM 1031 CD1 LEU A 62 13.081 11.357 -10.057 1.00 0.00 C ATOM 1032 CD2 LEU A 62 13.199 8.893 -10.459 1.00 0.00 C ATOM 0 H LEU A 62 8.553 9.941 -9.975 1.00 0.00 H new ATOM 0 HA LEU A 62 10.419 12.093 -10.100 1.00 0.00 H new ATOM 0 HB2 LEU A 62 10.933 9.824 -9.280 1.00 0.00 H new ATOM 0 HB3 LEU A 62 10.560 9.149 -10.854 1.00 0.00 H new ATOM 0 HG LEU A 62 12.476 10.362 -11.836 1.00 0.00 H new ATOM 0 HD11 LEU A 62 14.123 11.442 -10.366 1.00 0.00 H new ATOM 0 HD12 LEU A 62 12.549 12.271 -10.319 1.00 0.00 H new ATOM 0 HD13 LEU A 62 13.034 11.206 -8.978 1.00 0.00 H new ATOM 0 HD21 LEU A 62 14.241 9.010 -10.756 1.00 0.00 H new ATOM 0 HD22 LEU A 62 13.147 8.684 -9.391 1.00 0.00 H new ATOM 0 HD23 LEU A 62 12.755 8.066 -11.013 1.00 0.00 H new ATOM 1044 N ASP A 63 9.135 10.989 -12.874 1.00 0.00 N ATOM 1045 CA ASP A 63 9.042 11.200 -14.316 1.00 0.00 C ATOM 1046 C ASP A 63 8.798 12.674 -14.621 1.00 0.00 C ATOM 1047 O ASP A 63 9.219 13.188 -15.656 1.00 0.00 O ATOM 1048 CB ASP A 63 7.925 10.335 -14.902 1.00 0.00 C ATOM 1049 CG ASP A 63 7.906 10.336 -16.415 1.00 0.00 C ATOM 1050 OD1 ASP A 63 8.956 10.049 -17.026 1.00 0.00 O ATOM 1051 OD2 ASP A 63 6.832 10.578 -16.999 1.00 0.00 O ATOM 0 H ASP A 63 8.408 10.384 -12.493 1.00 0.00 H new ATOM 0 HA ASP A 63 9.985 10.907 -14.777 1.00 0.00 H new ATOM 0 HB2 ASP A 63 8.042 9.311 -14.547 1.00 0.00 H new ATOM 0 HB3 ASP A 63 6.964 10.693 -14.532 1.00 0.00 H new ATOM 1056 N GLU A 64 8.138 13.351 -13.687 1.00 0.00 N ATOM 1057 CA GLU A 64 7.945 14.794 -13.767 1.00 0.00 C ATOM 1058 C GLU A 64 9.284 15.522 -13.797 1.00 0.00 C ATOM 1059 O GLU A 64 9.450 16.516 -14.505 1.00 0.00 O ATOM 1060 CB GLU A 64 7.121 15.276 -12.571 1.00 0.00 C ATOM 1061 CG GLU A 64 5.630 15.318 -12.837 1.00 0.00 C ATOM 1062 CD GLU A 64 5.265 16.421 -13.803 1.00 0.00 C ATOM 1063 OE1 GLU A 64 5.142 17.581 -13.359 1.00 0.00 O ATOM 1064 OE2 GLU A 64 5.129 16.148 -15.013 1.00 0.00 O ATOM 0 H GLU A 64 7.725 12.919 -12.860 1.00 0.00 H new ATOM 0 HA GLU A 64 7.411 15.017 -14.691 1.00 0.00 H new ATOM 0 HB2 GLU A 64 7.311 14.620 -11.722 1.00 0.00 H new ATOM 0 HB3 GLU A 64 7.459 16.272 -12.286 1.00 0.00 H new ATOM 0 HG2 GLU A 64 5.305 14.359 -13.240 1.00 0.00 H new ATOM 0 HG3 GLU A 64 5.097 15.466 -11.898 1.00 0.00 H new ATOM 1071 N LEU A 65 10.239 15.013 -13.031 1.00 0.00 N ATOM 1072 CA LEU A 65 11.564 15.608 -12.959 1.00 0.00 C ATOM 1073 C LEU A 65 12.393 15.205 -14.173 1.00 0.00 C ATOM 1074 O LEU A 65 13.246 15.961 -14.632 1.00 0.00 O ATOM 1075 CB LEU A 65 12.267 15.184 -11.666 1.00 0.00 C ATOM 1076 CG LEU A 65 11.547 15.585 -10.376 1.00 0.00 C ATOM 1077 CD1 LEU A 65 12.309 15.080 -9.162 1.00 0.00 C ATOM 1078 CD2 LEU A 65 11.374 17.094 -10.305 1.00 0.00 C ATOM 0 H LEU A 65 10.118 14.185 -12.448 1.00 0.00 H new ATOM 0 HA LEU A 65 11.459 16.693 -12.957 1.00 0.00 H new ATOM 0 HB2 LEU A 65 12.388 14.101 -11.675 1.00 0.00 H new ATOM 0 HB3 LEU A 65 13.267 15.617 -11.655 1.00 0.00 H new ATOM 0 HG LEU A 65 10.558 15.126 -10.379 1.00 0.00 H new ATOM 0 HD11 LEU A 65 11.783 15.374 -8.254 1.00 0.00 H new ATOM 0 HD12 LEU A 65 12.381 13.993 -9.204 1.00 0.00 H new ATOM 0 HD13 LEU A 65 13.311 15.510 -9.156 1.00 0.00 H new ATOM 0 HD21 LEU A 65 10.860 17.358 -9.381 1.00 0.00 H new ATOM 0 HD22 LEU A 65 12.352 17.574 -10.326 1.00 0.00 H new ATOM 0 HD23 LEU A 65 10.785 17.433 -11.157 1.00 0.00 H new ATOM 1267 N PRO A 75 16.999 18.521 -12.118 1.00 0.00 N ATOM 1268 CA PRO A 75 17.009 18.834 -10.687 1.00 0.00 C ATOM 1269 C PRO A 75 18.096 18.050 -9.951 1.00 0.00 C ATOM 1270 O PRO A 75 17.841 16.974 -9.416 1.00 0.00 O ATOM 1271 CB PRO A 75 15.614 18.414 -10.200 1.00 0.00 C ATOM 1272 CG PRO A 75 14.790 18.285 -11.437 1.00 0.00 C ATOM 1273 CD PRO A 75 15.738 17.881 -12.529 1.00 0.00 C ATOM 0 HA PRO A 75 17.224 19.886 -10.499 1.00 0.00 H new ATOM 0 HB2 PRO A 75 15.655 17.471 -9.654 1.00 0.00 H new ATOM 0 HB3 PRO A 75 15.193 19.157 -9.522 1.00 0.00 H new ATOM 0 HG2 PRO A 75 14.005 17.540 -11.307 1.00 0.00 H new ATOM 0 HG3 PRO A 75 14.298 19.227 -11.677 1.00 0.00 H new ATOM 0 HD2 PRO A 75 15.838 16.798 -12.598 1.00 0.00 H new ATOM 0 HD3 PRO A 75 15.405 18.233 -13.505 1.00 0.00 H new ATOM 1281 N SER A 76 19.307 18.604 -9.946 1.00 0.00 N ATOM 1282 CA SER A 76 20.490 17.931 -9.414 1.00 0.00 C ATOM 1283 C SER A 76 20.250 17.333 -8.027 1.00 0.00 C ATOM 1284 O SER A 76 20.558 16.165 -7.788 1.00 0.00 O ATOM 1285 CB SER A 76 21.657 18.918 -9.366 1.00 0.00 C ATOM 1286 OG SER A 76 21.838 19.545 -10.628 1.00 0.00 O ATOM 0 H SER A 76 19.496 19.537 -10.313 1.00 0.00 H new ATOM 0 HA SER A 76 20.726 17.101 -10.080 1.00 0.00 H new ATOM 0 HB2 SER A 76 21.469 19.673 -8.603 1.00 0.00 H new ATOM 0 HB3 SER A 76 22.570 18.396 -9.080 1.00 0.00 H new ATOM 0 HG SER A 76 22.588 20.174 -10.576 1.00 0.00 H new ATOM 1292 N ASN A 77 19.683 18.121 -7.128 1.00 0.00 N ATOM 1293 CA ASN A 77 19.462 17.671 -5.761 1.00 0.00 C ATOM 1294 C ASN A 77 18.103 16.992 -5.618 1.00 0.00 C ATOM 1295 O ASN A 77 17.997 15.907 -5.047 1.00 0.00 O ATOM 1296 CB ASN A 77 19.573 18.851 -4.789 1.00 0.00 C ATOM 1297 CG ASN A 77 19.241 18.475 -3.355 1.00 0.00 C ATOM 1298 OD1 ASN A 77 18.093 18.582 -2.925 1.00 0.00 O ATOM 1299 ND2 ASN A 77 20.243 18.029 -2.609 1.00 0.00 N ATOM 0 H ASN A 77 19.368 19.072 -7.318 1.00 0.00 H new ATOM 0 HA ASN A 77 20.232 16.939 -5.517 1.00 0.00 H new ATOM 0 HB2 ASN A 77 20.586 19.252 -4.828 1.00 0.00 H new ATOM 0 HB3 ASN A 77 18.902 19.646 -5.114 1.00 0.00 H new ATOM 0 HD21 ASN A 77 20.076 17.759 -1.640 1.00 0.00 H new ATOM 0 HD22 ASN A 77 21.180 17.956 -3.005 1.00 0.00 H new ATOM 1306 N ARG A 78 17.074 17.617 -6.173 1.00 0.00 N ATOM 1307 CA ARG A 78 15.700 17.167 -5.968 1.00 0.00 C ATOM 1308 C ARG A 78 15.406 15.835 -6.659 1.00 0.00 C ATOM 1309 O ARG A 78 14.549 15.079 -6.202 1.00 0.00 O ATOM 1310 CB ARG A 78 14.725 18.249 -6.429 1.00 0.00 C ATOM 1311 CG ARG A 78 14.839 19.520 -5.605 1.00 0.00 C ATOM 1312 CD ARG A 78 13.969 20.638 -6.145 1.00 0.00 C ATOM 1313 NE ARG A 78 14.170 21.878 -5.395 1.00 0.00 N ATOM 1314 CZ ARG A 78 13.593 23.040 -5.695 1.00 0.00 C ATOM 1315 NH1 ARG A 78 12.810 23.146 -6.761 1.00 0.00 N ATOM 1316 NH2 ARG A 78 13.818 24.106 -4.940 1.00 0.00 N ATOM 0 H ARG A 78 17.163 18.439 -6.770 1.00 0.00 H new ATOM 0 HA ARG A 78 15.568 16.993 -4.900 1.00 0.00 H new ATOM 0 HB2 ARG A 78 14.913 18.481 -7.477 1.00 0.00 H new ATOM 0 HB3 ARG A 78 13.706 17.868 -6.364 1.00 0.00 H new ATOM 0 HG2 ARG A 78 14.556 19.308 -4.574 1.00 0.00 H new ATOM 0 HG3 ARG A 78 15.879 19.847 -5.589 1.00 0.00 H new ATOM 0 HD2 ARG A 78 14.200 20.805 -7.197 1.00 0.00 H new ATOM 0 HD3 ARG A 78 12.921 20.344 -6.092 1.00 0.00 H new ATOM 0 HE ARG A 78 14.794 21.851 -4.588 1.00 0.00 H new ATOM 0 HH11 ARG A 78 12.647 22.334 -7.357 1.00 0.00 H new ATOM 0 HH12 ARG A 78 12.371 24.039 -6.985 1.00 0.00 H new ATOM 0 HH21 ARG A 78 14.433 24.036 -4.129 1.00 0.00 H new ATOM 0 HH22 ARG A 78 13.376 24.996 -5.170 1.00 0.00 H new ATOM 1330 N GLN A 79 16.116 15.532 -7.742 1.00 0.00 N ATOM 1331 CA GLN A 79 15.932 14.251 -8.420 1.00 0.00 C ATOM 1332 C GLN A 79 16.523 13.129 -7.573 1.00 0.00 C ATOM 1333 O GLN A 79 15.944 12.048 -7.458 1.00 0.00 O ATOM 1334 CB GLN A 79 16.574 14.262 -9.810 1.00 0.00 C ATOM 1335 CG GLN A 79 16.262 13.020 -10.633 1.00 0.00 C ATOM 1336 CD GLN A 79 16.879 13.059 -12.018 1.00 0.00 C ATOM 1337 OE1 GLN A 79 17.071 14.127 -12.597 1.00 0.00 O ATOM 1338 NE2 GLN A 79 17.176 11.891 -12.568 1.00 0.00 N ATOM 0 H GLN A 79 16.814 16.145 -8.164 1.00 0.00 H new ATOM 0 HA GLN A 79 14.863 14.081 -8.548 1.00 0.00 H new ATOM 0 HB2 GLN A 79 16.232 15.143 -10.353 1.00 0.00 H new ATOM 0 HB3 GLN A 79 17.655 14.354 -9.702 1.00 0.00 H new ATOM 0 HG2 GLN A 79 16.625 12.139 -10.104 1.00 0.00 H new ATOM 0 HG3 GLN A 79 15.181 12.914 -10.725 1.00 0.00 H new ATOM 0 HE21 GLN A 79 17.002 11.027 -12.055 1.00 0.00 H new ATOM 0 HE22 GLN A 79 17.579 11.856 -13.504 1.00 0.00 H new ATOM 1347 N VAL A 80 17.670 13.402 -6.964 1.00 0.00 N ATOM 1348 CA VAL A 80 18.304 12.447 -6.069 1.00 0.00 C ATOM 1349 C VAL A 80 17.482 12.309 -4.789 1.00 0.00 C ATOM 1350 O VAL A 80 17.365 11.223 -4.227 1.00 0.00 O ATOM 1351 CB VAL A 80 19.750 12.869 -5.722 1.00 0.00 C ATOM 1352 CG1 VAL A 80 20.406 11.859 -4.793 1.00 0.00 C ATOM 1353 CG2 VAL A 80 20.574 13.037 -6.992 1.00 0.00 C ATOM 0 H VAL A 80 18.180 14.279 -7.075 1.00 0.00 H new ATOM 0 HA VAL A 80 18.348 11.486 -6.581 1.00 0.00 H new ATOM 0 HB VAL A 80 19.707 13.827 -5.204 1.00 0.00 H new ATOM 0 HG11 VAL A 80 21.422 12.181 -4.565 1.00 0.00 H new ATOM 0 HG12 VAL A 80 19.832 11.788 -3.869 1.00 0.00 H new ATOM 0 HG13 VAL A 80 20.434 10.883 -5.278 1.00 0.00 H new ATOM 0 HG21 VAL A 80 21.589 13.334 -6.730 1.00 0.00 H new ATOM 0 HG22 VAL A 80 20.601 12.093 -7.536 1.00 0.00 H new ATOM 0 HG23 VAL A 80 20.122 13.804 -7.620 1.00 0.00 H new ATOM 1363 N LEU A 81 16.897 13.419 -4.353 1.00 0.00 N ATOM 1364 CA LEU A 81 16.027 13.421 -3.182 1.00 0.00 C ATOM 1365 C LEU A 81 14.809 12.532 -3.426 1.00 0.00 C ATOM 1366 O LEU A 81 14.404 11.765 -2.551 1.00 0.00 O ATOM 1367 CB LEU A 81 15.585 14.850 -2.854 1.00 0.00 C ATOM 1368 CG LEU A 81 14.771 15.002 -1.567 1.00 0.00 C ATOM 1369 CD1 LEU A 81 15.596 14.583 -0.360 1.00 0.00 C ATOM 1370 CD2 LEU A 81 14.291 16.435 -1.413 1.00 0.00 C ATOM 0 H LEU A 81 17.010 14.332 -4.794 1.00 0.00 H new ATOM 0 HA LEU A 81 16.583 13.024 -2.333 1.00 0.00 H new ATOM 0 HB2 LEU A 81 16.472 15.479 -2.780 1.00 0.00 H new ATOM 0 HB3 LEU A 81 14.993 15.230 -3.686 1.00 0.00 H new ATOM 0 HG LEU A 81 13.900 14.349 -1.629 1.00 0.00 H new ATOM 0 HD11 LEU A 81 15.000 14.698 0.546 1.00 0.00 H new ATOM 0 HD12 LEU A 81 15.895 13.540 -0.468 1.00 0.00 H new ATOM 0 HD13 LEU A 81 16.485 15.210 -0.292 1.00 0.00 H new ATOM 0 HD21 LEU A 81 13.713 16.528 -0.493 1.00 0.00 H new ATOM 0 HD22 LEU A 81 15.150 17.104 -1.371 1.00 0.00 H new ATOM 0 HD23 LEU A 81 13.664 16.702 -2.264 1.00 0.00 H new ATOM 1382 N LEU A 82 14.237 12.640 -4.622 1.00 0.00 N ATOM 1383 CA LEU A 82 13.135 11.775 -5.035 1.00 0.00 C ATOM 1384 C LEU A 82 13.589 10.318 -4.961 1.00 0.00 C ATOM 1385 O LEU A 82 12.922 9.475 -4.363 1.00 0.00 O ATOM 1386 CB LEU A 82 12.695 12.139 -6.468 1.00 0.00 C ATOM 1387 CG LEU A 82 11.305 11.648 -6.926 1.00 0.00 C ATOM 1388 CD1 LEU A 82 11.206 10.131 -6.926 1.00 0.00 C ATOM 1389 CD2 LEU A 82 10.206 12.252 -6.068 1.00 0.00 C ATOM 0 H LEU A 82 14.520 13.322 -5.326 1.00 0.00 H new ATOM 0 HA LEU A 82 12.283 11.914 -4.370 1.00 0.00 H new ATOM 0 HB2 LEU A 82 12.718 13.225 -6.563 1.00 0.00 H new ATOM 0 HB3 LEU A 82 13.438 11.743 -7.160 1.00 0.00 H new ATOM 0 HG LEU A 82 11.171 11.985 -7.954 1.00 0.00 H new ATOM 0 HD11 LEU A 82 10.211 9.831 -7.255 1.00 0.00 H new ATOM 0 HD12 LEU A 82 11.952 9.718 -7.604 1.00 0.00 H new ATOM 0 HD13 LEU A 82 11.384 9.755 -5.919 1.00 0.00 H new ATOM 0 HD21 LEU A 82 9.237 11.890 -6.411 1.00 0.00 H new ATOM 0 HD22 LEU A 82 10.355 11.961 -5.028 1.00 0.00 H new ATOM 0 HD23 LEU A 82 10.237 13.339 -6.149 1.00 0.00 H new ATOM 1401 N GLN A 83 14.748 10.043 -5.553 1.00 0.00 N ATOM 1402 CA GLN A 83 15.303 8.696 -5.566 1.00 0.00 C ATOM 1403 C GLN A 83 15.505 8.170 -4.146 1.00 0.00 C ATOM 1404 O GLN A 83 15.247 6.999 -3.870 1.00 0.00 O ATOM 1405 CB GLN A 83 16.633 8.671 -6.321 1.00 0.00 C ATOM 1406 CG GLN A 83 17.238 7.283 -6.420 1.00 0.00 C ATOM 1407 CD GLN A 83 18.631 7.282 -7.013 1.00 0.00 C ATOM 1408 OE1 GLN A 83 18.974 8.128 -7.841 1.00 0.00 O ATOM 1409 NE2 GLN A 83 19.445 6.334 -6.583 1.00 0.00 N ATOM 0 H GLN A 83 15.321 10.738 -6.031 1.00 0.00 H new ATOM 0 HA GLN A 83 14.590 8.049 -6.077 1.00 0.00 H new ATOM 0 HB2 GLN A 83 16.481 9.066 -7.325 1.00 0.00 H new ATOM 0 HB3 GLN A 83 17.340 9.334 -5.821 1.00 0.00 H new ATOM 0 HG2 GLN A 83 17.273 6.837 -5.426 1.00 0.00 H new ATOM 0 HG3 GLN A 83 16.590 6.653 -7.030 1.00 0.00 H new ATOM 0 HE21 GLN A 83 19.118 5.654 -5.896 1.00 0.00 H new ATOM 0 HE22 GLN A 83 20.400 6.282 -6.938 1.00 0.00 H new ATOM 1418 N GLN A 84 15.963 9.037 -3.250 1.00 0.00 N ATOM 1419 CA GLN A 84 16.184 8.648 -1.862 1.00 0.00 C ATOM 1420 C GLN A 84 14.868 8.410 -1.139 1.00 0.00 C ATOM 1421 O GLN A 84 14.805 7.603 -0.213 1.00 0.00 O ATOM 1422 CB GLN A 84 17.014 9.695 -1.119 1.00 0.00 C ATOM 1423 CG GLN A 84 18.471 9.717 -1.546 1.00 0.00 C ATOM 1424 CD GLN A 84 19.344 10.533 -0.617 1.00 0.00 C ATOM 1425 OE1 GLN A 84 18.905 11.520 -0.029 1.00 0.00 O ATOM 1426 NE2 GLN A 84 20.590 10.112 -0.466 1.00 0.00 N ATOM 0 H GLN A 84 16.188 10.010 -3.458 1.00 0.00 H new ATOM 0 HA GLN A 84 16.742 7.712 -1.874 1.00 0.00 H new ATOM 0 HB2 GLN A 84 16.578 10.680 -1.286 1.00 0.00 H new ATOM 0 HB3 GLN A 84 16.959 9.500 -0.048 1.00 0.00 H new ATOM 0 HG2 GLN A 84 18.848 8.695 -1.587 1.00 0.00 H new ATOM 0 HG3 GLN A 84 18.543 10.124 -2.555 1.00 0.00 H new ATOM 0 HE21 GLN A 84 20.915 9.288 -0.972 1.00 0.00 H new ATOM 0 HE22 GLN A 84 21.225 10.611 0.157 1.00 0.00 H new ATOM 1435 N ARG A 85 13.818 9.101 -1.561 1.00 0.00 N ATOM 1436 CA ARG A 85 12.489 8.867 -1.011 1.00 0.00 C ATOM 1437 C ARG A 85 12.013 7.485 -1.445 1.00 0.00 C ATOM 1438 O ARG A 85 11.562 6.686 -0.625 1.00 0.00 O ATOM 1439 CB ARG A 85 11.509 9.953 -1.480 1.00 0.00 C ATOM 1440 CG ARG A 85 10.261 10.084 -0.613 1.00 0.00 C ATOM 1441 CD ARG A 85 9.291 8.924 -0.799 1.00 0.00 C ATOM 1442 NE ARG A 85 8.567 9.002 -2.066 1.00 0.00 N ATOM 1443 CZ ARG A 85 7.300 9.402 -2.166 1.00 0.00 C ATOM 1444 NH1 ARG A 85 6.635 9.790 -1.081 1.00 0.00 N ATOM 1445 NH2 ARG A 85 6.699 9.428 -3.341 1.00 0.00 N ATOM 0 H ARG A 85 13.859 9.825 -2.279 1.00 0.00 H new ATOM 0 HA ARG A 85 12.532 8.911 0.077 1.00 0.00 H new ATOM 0 HB2 ARG A 85 12.028 10.912 -1.498 1.00 0.00 H new ATOM 0 HB3 ARG A 85 11.205 9.735 -2.504 1.00 0.00 H new ATOM 0 HG2 ARG A 85 10.556 10.141 0.435 1.00 0.00 H new ATOM 0 HG3 ARG A 85 9.754 11.018 -0.853 1.00 0.00 H new ATOM 0 HD2 ARG A 85 9.840 7.984 -0.755 1.00 0.00 H new ATOM 0 HD3 ARG A 85 8.577 8.915 0.025 1.00 0.00 H new ATOM 0 HE ARG A 85 9.058 8.736 -2.920 1.00 0.00 H new ATOM 0 HH11 ARG A 85 7.095 9.782 -0.171 1.00 0.00 H new ATOM 0 HH12 ARG A 85 5.665 10.096 -1.159 1.00 0.00 H new ATOM 0 HH21 ARG A 85 7.205 9.141 -4.179 1.00 0.00 H new ATOM 0 HH22 ARG A 85 5.729 9.735 -3.411 1.00 0.00 H new ATOM 1459 N ARG A 86 12.132 7.225 -2.742 1.00 0.00 N ATOM 1460 CA ARG A 86 11.842 5.914 -3.316 1.00 0.00 C ATOM 1461 C ARG A 86 12.639 4.829 -2.587 1.00 0.00 C ATOM 1462 O ARG A 86 12.118 3.759 -2.266 1.00 0.00 O ATOM 1463 CB ARG A 86 12.203 5.937 -4.805 1.00 0.00 C ATOM 1464 CG ARG A 86 11.957 4.636 -5.552 1.00 0.00 C ATOM 1465 CD ARG A 86 12.407 4.765 -7.000 1.00 0.00 C ATOM 1466 NE ARG A 86 12.180 3.548 -7.782 1.00 0.00 N ATOM 1467 CZ ARG A 86 12.020 3.543 -9.109 1.00 0.00 C ATOM 1468 NH1 ARG A 86 12.097 4.683 -9.788 1.00 0.00 N ATOM 1469 NH2 ARG A 86 11.809 2.402 -9.756 1.00 0.00 N ATOM 0 H ARG A 86 12.433 7.918 -3.427 1.00 0.00 H new ATOM 0 HA ARG A 86 10.782 5.687 -3.202 1.00 0.00 H new ATOM 0 HB2 ARG A 86 11.631 6.729 -5.289 1.00 0.00 H new ATOM 0 HB3 ARG A 86 13.256 6.200 -4.903 1.00 0.00 H new ATOM 0 HG2 ARG A 86 12.497 3.823 -5.067 1.00 0.00 H new ATOM 0 HG3 ARG A 86 10.898 4.382 -5.515 1.00 0.00 H new ATOM 0 HD2 ARG A 86 11.876 5.594 -7.467 1.00 0.00 H new ATOM 0 HD3 ARG A 86 13.468 5.013 -7.024 1.00 0.00 H new ATOM 0 HE ARG A 86 12.142 2.657 -7.288 1.00 0.00 H new ATOM 0 HH11 ARG A 86 12.278 5.558 -9.296 1.00 0.00 H new ATOM 0 HH12 ARG A 86 11.975 4.683 -10.801 1.00 0.00 H new ATOM 0 HH21 ARG A 86 11.768 1.523 -9.240 1.00 0.00 H new ATOM 0 HH22 ARG A 86 11.688 2.405 -10.769 1.00 0.00 H new ATOM 1483 N ASP A 87 13.902 5.133 -2.323 1.00 0.00 N ATOM 1484 CA ASP A 87 14.791 4.224 -1.608 1.00 0.00 C ATOM 1485 C ASP A 87 14.326 4.012 -0.169 1.00 0.00 C ATOM 1486 O ASP A 87 14.218 2.875 0.292 1.00 0.00 O ATOM 1487 CB ASP A 87 16.220 4.774 -1.633 1.00 0.00 C ATOM 1488 CG ASP A 87 17.168 4.000 -0.742 1.00 0.00 C ATOM 1489 OD1 ASP A 87 17.498 2.841 -1.072 1.00 0.00 O ATOM 1490 OD2 ASP A 87 17.593 4.554 0.293 1.00 0.00 O ATOM 0 H ASP A 87 14.339 6.013 -2.597 1.00 0.00 H new ATOM 0 HA ASP A 87 14.769 3.256 -2.108 1.00 0.00 H new ATOM 0 HB2 ASP A 87 16.594 4.753 -2.657 1.00 0.00 H new ATOM 0 HB3 ASP A 87 16.207 5.818 -1.320 1.00 0.00 H new ATOM 1495 N GLN A 88 14.035 5.103 0.532 1.00 0.00 N ATOM 1496 CA GLN A 88 13.588 5.032 1.919 1.00 0.00 C ATOM 1497 C GLN A 88 12.274 4.264 2.028 1.00 0.00 C ATOM 1498 O GLN A 88 12.048 3.529 2.989 1.00 0.00 O ATOM 1499 CB GLN A 88 13.414 6.436 2.502 1.00 0.00 C ATOM 1500 CG GLN A 88 13.074 6.436 3.985 1.00 0.00 C ATOM 1501 CD GLN A 88 12.776 7.821 4.523 1.00 0.00 C ATOM 1502 OE1 GLN A 88 13.300 8.819 4.034 1.00 0.00 O ATOM 1503 NE2 GLN A 88 11.933 7.889 5.540 1.00 0.00 N ATOM 0 H GLN A 88 14.101 6.051 0.161 1.00 0.00 H new ATOM 0 HA GLN A 88 14.352 4.503 2.488 1.00 0.00 H new ATOM 0 HB2 GLN A 88 14.333 7.002 2.347 1.00 0.00 H new ATOM 0 HB3 GLN A 88 12.625 6.953 1.956 1.00 0.00 H new ATOM 0 HG2 GLN A 88 12.211 5.793 4.154 1.00 0.00 H new ATOM 0 HG3 GLN A 88 13.906 6.006 4.543 1.00 0.00 H new ATOM 0 HE21 GLN A 88 11.519 7.036 5.917 1.00 0.00 H new ATOM 0 HE22 GLN A 88 11.697 8.794 5.947 1.00 0.00 H new ATOM 1512 N GLU A 89 11.413 4.438 1.036 1.00 0.00 N ATOM 1513 CA GLU A 89 10.141 3.736 1.001 1.00 0.00 C ATOM 1514 C GLU A 89 10.363 2.237 0.842 1.00 0.00 C ATOM 1515 O GLU A 89 9.743 1.427 1.536 1.00 0.00 O ATOM 1516 CB GLU A 89 9.271 4.274 -0.132 1.00 0.00 C ATOM 1517 CG GLU A 89 7.924 3.590 -0.231 1.00 0.00 C ATOM 1518 CD GLU A 89 6.929 4.388 -1.035 1.00 0.00 C ATOM 1519 OE1 GLU A 89 6.538 5.480 -0.569 1.00 0.00 O ATOM 1520 OE2 GLU A 89 6.492 3.911 -2.094 1.00 0.00 O ATOM 0 H GLU A 89 11.574 5.060 0.244 1.00 0.00 H new ATOM 0 HA GLU A 89 9.623 3.906 1.945 1.00 0.00 H new ATOM 0 HB2 GLU A 89 9.118 5.343 0.014 1.00 0.00 H new ATOM 0 HB3 GLU A 89 9.802 4.154 -1.076 1.00 0.00 H new ATOM 0 HG2 GLU A 89 8.051 2.608 -0.687 1.00 0.00 H new ATOM 0 HG3 GLU A 89 7.529 3.427 0.771 1.00 0.00 H new ATOM 1527 N LEU A 90 11.265 1.873 -0.060 1.00 0.00 N ATOM 1528 CA LEU A 90 11.606 0.474 -0.275 1.00 0.00 C ATOM 1529 C LEU A 90 12.266 -0.108 0.975 1.00 0.00 C ATOM 1530 O LEU A 90 12.192 -1.311 1.229 1.00 0.00 O ATOM 1531 CB LEU A 90 12.534 0.332 -1.485 1.00 0.00 C ATOM 1532 CG LEU A 90 12.781 -1.105 -1.950 1.00 0.00 C ATOM 1533 CD1 LEU A 90 11.487 -1.740 -2.435 1.00 0.00 C ATOM 1534 CD2 LEU A 90 13.838 -1.135 -3.045 1.00 0.00 C ATOM 0 H LEU A 90 11.773 2.528 -0.654 1.00 0.00 H new ATOM 0 HA LEU A 90 10.690 -0.082 -0.475 1.00 0.00 H new ATOM 0 HB2 LEU A 90 12.112 0.898 -2.315 1.00 0.00 H new ATOM 0 HB3 LEU A 90 13.494 0.789 -1.243 1.00 0.00 H new ATOM 0 HG LEU A 90 13.148 -1.684 -1.102 1.00 0.00 H new ATOM 0 HD11 LEU A 90 11.683 -2.761 -2.761 1.00 0.00 H new ATOM 0 HD12 LEU A 90 10.761 -1.752 -1.622 1.00 0.00 H new ATOM 0 HD13 LEU A 90 11.089 -1.163 -3.269 1.00 0.00 H new ATOM 0 HD21 LEU A 90 14.002 -2.164 -3.364 1.00 0.00 H new ATOM 0 HD22 LEU A 90 13.499 -0.541 -3.894 1.00 0.00 H new ATOM 0 HD23 LEU A 90 14.771 -0.721 -2.662 1.00 0.00 H new ATOM 1546 N LYS A 91 12.908 0.757 1.754 1.00 0.00 N ATOM 1547 CA LYS A 91 13.491 0.364 3.030 1.00 0.00 C ATOM 1548 C LYS A 91 12.403 -0.046 4.014 1.00 0.00 C ATOM 1549 O LYS A 91 12.454 -1.132 4.586 1.00 0.00 O ATOM 1550 CB LYS A 91 14.309 1.513 3.629 1.00 0.00 C ATOM 1551 CG LYS A 91 15.687 1.682 3.018 1.00 0.00 C ATOM 1552 CD LYS A 91 16.291 3.027 3.383 1.00 0.00 C ATOM 1553 CE LYS A 91 17.775 3.080 3.063 1.00 0.00 C ATOM 1554 NZ LYS A 91 18.254 4.472 2.868 1.00 0.00 N ATOM 0 H LYS A 91 13.038 1.741 1.521 1.00 0.00 H new ATOM 0 HA LYS A 91 14.149 -0.486 2.848 1.00 0.00 H new ATOM 0 HB2 LYS A 91 13.753 2.442 3.506 1.00 0.00 H new ATOM 0 HB3 LYS A 91 14.417 1.346 4.701 1.00 0.00 H new ATOM 0 HG2 LYS A 91 16.341 0.881 3.363 1.00 0.00 H new ATOM 0 HG3 LYS A 91 15.620 1.593 1.934 1.00 0.00 H new ATOM 0 HD2 LYS A 91 15.773 3.818 2.841 1.00 0.00 H new ATOM 0 HD3 LYS A 91 16.140 3.218 4.446 1.00 0.00 H new ATOM 0 HE2 LYS A 91 18.337 2.614 3.872 1.00 0.00 H new ATOM 0 HE3 LYS A 91 17.972 2.499 2.162 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 19.292 4.476 2.804 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 17.851 4.858 1.990 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 17.955 5.058 3.673 1.00 0.00 H new ATOM 1568 N GLU A 92 11.419 0.827 4.191 1.00 0.00 N ATOM 1569 CA GLU A 92 10.341 0.590 5.148 1.00 0.00 C ATOM 1570 C GLU A 92 9.524 -0.638 4.751 1.00 0.00 C ATOM 1571 O GLU A 92 9.097 -1.415 5.611 1.00 0.00 O ATOM 1572 CB GLU A 92 9.444 1.830 5.251 1.00 0.00 C ATOM 1573 CG GLU A 92 8.321 1.694 6.269 1.00 0.00 C ATOM 1574 CD GLU A 92 7.662 3.021 6.597 1.00 0.00 C ATOM 1575 OE1 GLU A 92 6.741 3.436 5.862 1.00 0.00 O ATOM 1576 OE2 GLU A 92 8.067 3.653 7.596 1.00 0.00 O ATOM 0 H GLU A 92 11.344 1.709 3.684 1.00 0.00 H new ATOM 0 HA GLU A 92 10.781 0.398 6.126 1.00 0.00 H new ATOM 0 HB2 GLU A 92 10.059 2.690 5.515 1.00 0.00 H new ATOM 0 HB3 GLU A 92 9.011 2.036 4.272 1.00 0.00 H new ATOM 0 HG2 GLU A 92 7.569 1.005 5.884 1.00 0.00 H new ATOM 0 HG3 GLU A 92 8.717 1.254 7.184 1.00 0.00 H new ATOM 1583 N PHE A 93 9.320 -0.819 3.452 1.00 0.00 N ATOM 1584 CA PHE A 93 8.597 -1.981 2.953 1.00 0.00 C ATOM 1585 C PHE A 93 9.377 -3.264 3.207 1.00 0.00 C ATOM 1586 O PHE A 93 8.862 -4.204 3.811 1.00 0.00 O ATOM 1587 CB PHE A 93 8.302 -1.850 1.454 1.00 0.00 C ATOM 1588 CG PHE A 93 7.787 -3.123 0.834 1.00 0.00 C ATOM 1589 CD1 PHE A 93 6.537 -3.618 1.172 1.00 0.00 C ATOM 1590 CD2 PHE A 93 8.556 -3.830 -0.079 1.00 0.00 C ATOM 1591 CE1 PHE A 93 6.066 -4.791 0.611 1.00 0.00 C ATOM 1592 CE2 PHE A 93 8.090 -5.003 -0.641 1.00 0.00 C ATOM 1593 CZ PHE A 93 6.842 -5.483 -0.295 1.00 0.00 C ATOM 0 H PHE A 93 9.644 -0.178 2.728 1.00 0.00 H new ATOM 0 HA PHE A 93 7.652 -2.028 3.495 1.00 0.00 H new ATOM 0 HB2 PHE A 93 7.568 -1.058 1.303 1.00 0.00 H new ATOM 0 HB3 PHE A 93 9.212 -1.545 0.937 1.00 0.00 H new ATOM 0 HD1 PHE A 93 5.924 -3.082 1.881 1.00 0.00 H new ATOM 0 HD2 PHE A 93 9.532 -3.458 -0.354 1.00 0.00 H new ATOM 0 HE1 PHE A 93 5.090 -5.165 0.883 1.00 0.00 H new ATOM 0 HE2 PHE A 93 8.700 -5.543 -1.349 1.00 0.00 H new ATOM 0 HZ PHE A 93 6.474 -6.399 -0.733 1.00 0.00 H new ATOM 1603 N LYS A 94 10.634 -3.285 2.769 1.00 0.00 N ATOM 1604 CA LYS A 94 11.413 -4.516 2.783 1.00 0.00 C ATOM 1605 C LYS A 94 12.010 -4.791 4.163 1.00 0.00 C ATOM 1606 O LYS A 94 12.857 -5.671 4.320 1.00 0.00 O ATOM 1607 CB LYS A 94 12.512 -4.477 1.721 1.00 0.00 C ATOM 1608 CG LYS A 94 12.869 -5.854 1.182 1.00 0.00 C ATOM 1609 CD LYS A 94 14.028 -5.804 0.200 1.00 0.00 C ATOM 1610 CE LYS A 94 15.379 -5.838 0.902 1.00 0.00 C ATOM 1611 NZ LYS A 94 15.551 -4.722 1.866 1.00 0.00 N ATOM 0 H LYS A 94 11.129 -2.471 2.404 1.00 0.00 H new ATOM 0 HA LYS A 94 10.732 -5.334 2.548 1.00 0.00 H new ATOM 0 HB2 LYS A 94 12.189 -3.843 0.896 1.00 0.00 H new ATOM 0 HB3 LYS A 94 13.404 -4.017 2.146 1.00 0.00 H new ATOM 0 HG2 LYS A 94 13.127 -6.512 2.012 1.00 0.00 H new ATOM 0 HG3 LYS A 94 11.998 -6.287 0.691 1.00 0.00 H new ATOM 0 HD2 LYS A 94 13.956 -6.647 -0.487 1.00 0.00 H new ATOM 0 HD3 LYS A 94 13.955 -4.897 -0.400 1.00 0.00 H new ATOM 0 HE2 LYS A 94 15.487 -6.787 1.428 1.00 0.00 H new ATOM 0 HE3 LYS A 94 16.173 -5.794 0.156 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 16.559 -4.616 2.098 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 15.198 -3.840 1.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 15.016 -4.928 2.734 1.00 0.00 H new ATOM 1625 N ALA A 95 11.573 -4.033 5.155 1.00 0.00 N ATOM 1626 CA ALA A 95 11.944 -4.295 6.537 1.00 0.00 C ATOM 1627 C ALA A 95 10.738 -4.814 7.306 1.00 0.00 C ATOM 1628 O ALA A 95 10.764 -4.930 8.534 1.00 0.00 O ATOM 1629 CB ALA A 95 12.499 -3.039 7.192 1.00 0.00 C ATOM 0 H ALA A 95 10.959 -3.228 5.029 1.00 0.00 H new ATOM 0 HA ALA A 95 12.725 -5.055 6.553 1.00 0.00 H new ATOM 0 HB1 ALA A 95 12.770 -3.257 8.225 1.00 0.00 H new ATOM 0 HB2 ALA A 95 13.382 -2.705 6.648 1.00 0.00 H new ATOM 0 HB3 ALA A 95 11.743 -2.254 7.173 1.00 0.00 H new ATOM 1635 N GLY A 96 9.686 -5.138 6.567 1.00 0.00 N ATOM 1636 CA GLY A 96 8.459 -5.605 7.176 1.00 0.00 C ATOM 1637 C GLY A 96 7.424 -4.505 7.240 1.00 0.00 C ATOM 1638 O GLY A 96 7.247 -3.871 8.282 1.00 0.00 O ATOM 0 H GLY A 96 9.662 -5.085 5.549 1.00 0.00 H new ATOM 0 HA2 GLY A 96 8.064 -6.446 6.605 1.00 0.00 H new ATOM 0 HA3 GLY A 96 8.666 -5.971 8.181 1.00 0.00 H new ATOM 1642 N PHE A 97 6.748 -4.266 6.128 1.00 0.00 N ATOM 1643 CA PHE A 97 5.792 -3.174 6.033 1.00 0.00 C ATOM 1644 C PHE A 97 4.499 -3.524 6.765 1.00 0.00 C ATOM 1645 O PHE A 97 4.082 -4.685 6.791 1.00 0.00 O ATOM 1646 CB PHE A 97 5.500 -2.854 4.563 1.00 0.00 C ATOM 1647 CG PHE A 97 4.688 -1.605 4.358 1.00 0.00 C ATOM 1648 CD1 PHE A 97 5.260 -0.356 4.538 1.00 0.00 C ATOM 1649 CD2 PHE A 97 3.353 -1.681 3.995 1.00 0.00 C ATOM 1650 CE1 PHE A 97 4.518 0.794 4.355 1.00 0.00 C ATOM 1651 CE2 PHE A 97 2.605 -0.533 3.810 1.00 0.00 C ATOM 1652 CZ PHE A 97 3.188 0.706 3.992 1.00 0.00 C ATOM 0 H PHE A 97 6.844 -4.816 5.275 1.00 0.00 H new ATOM 0 HA PHE A 97 6.226 -2.293 6.506 1.00 0.00 H new ATOM 0 HB2 PHE A 97 6.445 -2.752 4.029 1.00 0.00 H new ATOM 0 HB3 PHE A 97 4.971 -3.696 4.117 1.00 0.00 H new ATOM 0 HD1 PHE A 97 6.299 -0.281 4.825 1.00 0.00 H new ATOM 0 HD2 PHE A 97 2.892 -2.647 3.855 1.00 0.00 H new ATOM 0 HE1 PHE A 97 4.977 1.761 4.496 1.00 0.00 H new ATOM 0 HE2 PHE A 97 1.566 -0.605 3.524 1.00 0.00 H new ATOM 0 HZ PHE A 97 2.605 1.604 3.851 1.00 0.00 H new ATOM 1662 N LEU A 98 3.883 -2.516 7.367 1.00 0.00 N ATOM 1663 CA LEU A 98 2.624 -2.694 8.072 1.00 0.00 C ATOM 1664 C LEU A 98 1.486 -2.860 7.070 1.00 0.00 C ATOM 1665 O LEU A 98 0.955 -1.879 6.547 1.00 0.00 O ATOM 1666 CB LEU A 98 2.359 -1.492 8.983 1.00 0.00 C ATOM 1667 CG LEU A 98 1.186 -1.653 9.950 1.00 0.00 C ATOM 1668 CD1 LEU A 98 1.490 -2.731 10.979 1.00 0.00 C ATOM 1669 CD2 LEU A 98 0.873 -0.331 10.633 1.00 0.00 C ATOM 0 H LEU A 98 4.239 -1.560 7.380 1.00 0.00 H new ATOM 0 HA LEU A 98 2.684 -3.592 8.687 1.00 0.00 H new ATOM 0 HB2 LEU A 98 3.260 -1.289 9.561 1.00 0.00 H new ATOM 0 HB3 LEU A 98 2.177 -0.617 8.359 1.00 0.00 H new ATOM 0 HG LEU A 98 0.308 -1.960 9.381 1.00 0.00 H new ATOM 0 HD11 LEU A 98 0.645 -2.833 11.660 1.00 0.00 H new ATOM 0 HD12 LEU A 98 1.664 -3.680 10.471 1.00 0.00 H new ATOM 0 HD13 LEU A 98 2.380 -2.454 11.544 1.00 0.00 H new ATOM 0 HD21 LEU A 98 0.035 -0.465 11.318 1.00 0.00 H new ATOM 0 HD22 LEU A 98 1.747 0.007 11.190 1.00 0.00 H new ATOM 0 HD23 LEU A 98 0.612 0.414 9.881 1.00 0.00 H new ATOM 1681 N CYS A 99 1.139 -4.102 6.788 1.00 0.00 N ATOM 1682 CA CYS A 99 0.131 -4.402 5.787 1.00 0.00 C ATOM 1683 C CYS A 99 -0.927 -5.338 6.359 1.00 0.00 C ATOM 1684 O CYS A 99 -0.619 -6.215 7.168 1.00 0.00 O ATOM 1685 CB CYS A 99 0.798 -5.043 4.562 1.00 0.00 C ATOM 1686 SG CYS A 99 -0.342 -5.473 3.222 1.00 0.00 S ATOM 0 H CYS A 99 1.542 -4.923 7.240 1.00 0.00 H new ATOM 0 HA CYS A 99 -0.357 -3.475 5.487 1.00 0.00 H new ATOM 0 HB2 CYS A 99 1.551 -4.357 4.174 1.00 0.00 H new ATOM 0 HB3 CYS A 99 1.321 -5.945 4.880 1.00 0.00 H new ATOM 0 HG CYS A 99 -1.232 -6.312 3.662 1.00 0.00 H new ATOM 1692 N PRO A 100 -2.199 -5.142 5.977 1.00 0.00 N ATOM 1693 CA PRO A 100 -3.272 -6.071 6.327 1.00 0.00 C ATOM 1694 C PRO A 100 -3.027 -7.447 5.713 1.00 0.00 C ATOM 1695 O PRO A 100 -2.414 -7.554 4.648 1.00 0.00 O ATOM 1696 CB PRO A 100 -4.529 -5.433 5.720 1.00 0.00 C ATOM 1697 CG PRO A 100 -4.165 -4.009 5.466 1.00 0.00 C ATOM 1698 CD PRO A 100 -2.689 -3.999 5.193 1.00 0.00 C ATOM 0 HA PRO A 100 -3.350 -6.226 7.403 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -4.818 -5.935 4.797 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -5.376 -5.507 6.402 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -4.721 -3.610 4.618 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -4.406 -3.386 6.327 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -2.474 -4.117 4.131 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -2.226 -3.064 5.510 1.00 0.00 H new ATOM 1706 N ASP A 101 -3.505 -8.488 6.386 1.00 0.00 N ATOM 1707 CA ASP A 101 -3.309 -9.866 5.929 1.00 0.00 C ATOM 1708 C ASP A 101 -3.949 -10.095 4.561 1.00 0.00 C ATOM 1709 O ASP A 101 -3.499 -10.951 3.793 1.00 0.00 O ATOM 1710 CB ASP A 101 -3.898 -10.852 6.942 1.00 0.00 C ATOM 1711 CG ASP A 101 -5.392 -10.671 7.125 1.00 0.00 C ATOM 1712 OD1 ASP A 101 -5.794 -9.865 7.985 1.00 0.00 O ATOM 1713 OD2 ASP A 101 -6.168 -11.333 6.409 1.00 0.00 O ATOM 0 H ASP A 101 -4.034 -8.407 7.254 1.00 0.00 H new ATOM 0 HA ASP A 101 -2.236 -10.034 5.840 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -3.696 -11.871 6.612 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -3.399 -10.723 7.902 1.00 0.00 H new ATOM 1718 N LEU A 102 -5.009 -9.336 4.278 1.00 0.00 N ATOM 1719 CA LEU A 102 -5.720 -9.418 3.003 1.00 0.00 C ATOM 1720 C LEU A 102 -6.207 -10.838 2.736 1.00 0.00 C ATOM 1721 O LEU A 102 -6.191 -11.310 1.601 1.00 0.00 O ATOM 1722 CB LEU A 102 -4.827 -8.939 1.852 1.00 0.00 C ATOM 1723 CG LEU A 102 -4.460 -7.455 1.890 1.00 0.00 C ATOM 1724 CD1 LEU A 102 -3.576 -7.091 0.708 1.00 0.00 C ATOM 1725 CD2 LEU A 102 -5.719 -6.599 1.899 1.00 0.00 C ATOM 0 H LEU A 102 -5.397 -8.649 4.925 1.00 0.00 H new ATOM 0 HA LEU A 102 -6.590 -8.764 3.065 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -3.908 -9.525 1.858 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -5.332 -9.148 0.909 1.00 0.00 H new ATOM 0 HG LEU A 102 -3.902 -7.261 2.806 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -3.326 -6.031 0.753 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -2.660 -7.682 0.743 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -4.107 -7.299 -0.221 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -5.442 -5.545 1.926 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -6.301 -6.798 0.999 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -6.317 -6.840 2.778 1.00 0.00 H new ATOM 1737 N SER A 103 -6.630 -11.518 3.789 1.00 0.00 N ATOM 1738 CA SER A 103 -7.177 -12.858 3.662 1.00 0.00 C ATOM 1739 C SER A 103 -8.449 -13.004 4.501 1.00 0.00 C ATOM 1740 O SER A 103 -9.370 -13.731 4.129 1.00 0.00 O ATOM 1741 CB SER A 103 -6.129 -13.883 4.095 1.00 0.00 C ATOM 1742 OG SER A 103 -4.878 -13.623 3.473 1.00 0.00 O ATOM 0 H SER A 103 -6.605 -11.162 4.745 1.00 0.00 H new ATOM 0 HA SER A 103 -7.439 -13.035 2.619 1.00 0.00 H new ATOM 0 HB2 SER A 103 -6.014 -13.856 5.179 1.00 0.00 H new ATOM 0 HB3 SER A 103 -6.467 -14.886 3.836 1.00 0.00 H new ATOM 0 HG SER A 103 -4.513 -12.779 3.812 1.00 0.00 H new ATOM 1748 N ASP A 104 -8.491 -12.313 5.636 1.00 0.00 N ATOM 1749 CA ASP A 104 -9.658 -12.337 6.514 1.00 0.00 C ATOM 1750 C ASP A 104 -10.729 -11.370 6.015 1.00 0.00 C ATOM 1751 O ASP A 104 -10.441 -10.210 5.710 1.00 0.00 O ATOM 1752 CB ASP A 104 -9.254 -11.980 7.945 1.00 0.00 C ATOM 1753 CG ASP A 104 -10.418 -12.043 8.915 1.00 0.00 C ATOM 1754 OD1 ASP A 104 -11.149 -11.043 9.041 1.00 0.00 O ATOM 1755 OD2 ASP A 104 -10.604 -13.096 9.563 1.00 0.00 O ATOM 0 H ASP A 104 -7.727 -11.727 5.971 1.00 0.00 H new ATOM 0 HA ASP A 104 -10.071 -13.346 6.505 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -8.472 -12.662 8.278 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -8.829 -10.976 7.959 1.00 0.00 H new ATOM 1760 N ALA A 105 -11.960 -11.858 5.941 1.00 0.00 N ATOM 1761 CA ALA A 105 -13.069 -11.088 5.393 1.00 0.00 C ATOM 1762 C ALA A 105 -13.517 -9.978 6.331 1.00 0.00 C ATOM 1763 O ALA A 105 -13.912 -8.909 5.880 1.00 0.00 O ATOM 1764 CB ALA A 105 -14.239 -12.006 5.070 1.00 0.00 C ATOM 0 H ALA A 105 -12.217 -12.793 6.257 1.00 0.00 H new ATOM 0 HA ALA A 105 -12.714 -10.616 4.477 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -15.061 -11.418 4.661 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -13.926 -12.750 4.338 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -14.569 -12.508 5.979 1.00 0.00 H new ATOM 1770 N LYS A 106 -13.450 -10.217 7.630 1.00 0.00 N ATOM 1771 CA LYS A 106 -13.887 -9.218 8.592 1.00 0.00 C ATOM 1772 C LYS A 106 -12.862 -8.099 8.712 1.00 0.00 C ATOM 1773 O LYS A 106 -13.225 -6.938 8.901 1.00 0.00 O ATOM 1774 CB LYS A 106 -14.196 -9.852 9.949 1.00 0.00 C ATOM 1775 CG LYS A 106 -15.539 -10.567 9.963 1.00 0.00 C ATOM 1776 CD LYS A 106 -15.895 -11.113 11.335 1.00 0.00 C ATOM 1777 CE LYS A 106 -17.359 -11.524 11.391 1.00 0.00 C ATOM 1778 NZ LYS A 106 -17.722 -12.137 12.693 1.00 0.00 N ATOM 0 H LYS A 106 -13.101 -11.084 8.040 1.00 0.00 H new ATOM 0 HA LYS A 106 -14.814 -8.778 8.226 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -13.408 -10.560 10.204 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -14.191 -9.079 10.718 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -16.317 -9.877 9.637 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -15.518 -11.386 9.244 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -15.263 -11.971 11.565 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -15.696 -10.357 12.095 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -17.986 -10.650 11.216 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -17.567 -12.232 10.588 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -18.728 -12.401 12.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -17.143 -12.986 12.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -17.550 -11.454 13.458 1.00 0.00 H new ATOM 1792 N ASN A 107 -11.587 -8.439 8.573 1.00 0.00 N ATOM 1793 CA ASN A 107 -10.548 -7.419 8.476 1.00 0.00 C ATOM 1794 C ASN A 107 -10.753 -6.613 7.199 1.00 0.00 C ATOM 1795 O ASN A 107 -10.527 -5.403 7.168 1.00 0.00 O ATOM 1796 CB ASN A 107 -9.142 -8.031 8.484 1.00 0.00 C ATOM 1797 CG ASN A 107 -8.771 -8.664 9.815 1.00 0.00 C ATOM 1798 OD1 ASN A 107 -9.287 -8.290 10.867 1.00 0.00 O ATOM 1799 ND2 ASN A 107 -7.837 -9.600 9.783 1.00 0.00 N ATOM 0 H ASN A 107 -11.249 -9.400 8.525 1.00 0.00 H new ATOM 0 HA ASN A 107 -10.628 -6.771 9.349 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -9.077 -8.785 7.700 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -8.414 -7.256 8.242 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -7.523 -10.037 10.650 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -7.431 -9.885 8.892 1.00 0.00 H new ATOM 1806 N MET A 108 -11.200 -7.299 6.147 1.00 0.00 N ATOM 1807 CA MET A 108 -11.537 -6.656 4.880 1.00 0.00 C ATOM 1808 C MET A 108 -12.712 -5.692 5.077 1.00 0.00 C ATOM 1809 O MET A 108 -12.768 -4.623 4.465 1.00 0.00 O ATOM 1810 CB MET A 108 -11.897 -7.718 3.831 1.00 0.00 C ATOM 1811 CG MET A 108 -12.080 -7.177 2.418 1.00 0.00 C ATOM 1812 SD MET A 108 -10.587 -7.313 1.407 1.00 0.00 S ATOM 1813 CE MET A 108 -9.475 -6.194 2.246 1.00 0.00 C ATOM 0 H MET A 108 -11.338 -8.310 6.150 1.00 0.00 H new ATOM 0 HA MET A 108 -10.673 -6.092 4.529 1.00 0.00 H new ATOM 0 HB2 MET A 108 -11.114 -8.476 3.817 1.00 0.00 H new ATOM 0 HB3 MET A 108 -12.817 -8.215 4.138 1.00 0.00 H new ATOM 0 HG2 MET A 108 -12.892 -7.717 1.931 1.00 0.00 H new ATOM 0 HG3 MET A 108 -12.381 -6.131 2.472 1.00 0.00 H new ATOM 0 HE1 MET A 108 -8.768 -5.778 1.529 1.00 0.00 H new ATOM 0 HE2 MET A 108 -10.047 -5.386 2.701 1.00 0.00 H new ATOM 0 HE3 MET A 108 -8.931 -6.734 3.021 1.00 0.00 H new ATOM 1823 N GLU A 109 -13.644 -6.082 5.945 1.00 0.00 N ATOM 1824 CA GLU A 109 -14.807 -5.259 6.264 1.00 0.00 C ATOM 1825 C GLU A 109 -14.398 -3.962 6.952 1.00 0.00 C ATOM 1826 O GLU A 109 -14.748 -2.873 6.495 1.00 0.00 O ATOM 1827 CB GLU A 109 -15.784 -6.030 7.154 1.00 0.00 C ATOM 1828 CG GLU A 109 -16.428 -7.213 6.458 1.00 0.00 C ATOM 1829 CD GLU A 109 -17.179 -6.804 5.212 1.00 0.00 C ATOM 1830 OE1 GLU A 109 -18.268 -6.211 5.342 1.00 0.00 O ATOM 1831 OE2 GLU A 109 -16.690 -7.069 4.098 1.00 0.00 O ATOM 0 H GLU A 109 -13.614 -6.971 6.443 1.00 0.00 H new ATOM 0 HA GLU A 109 -15.299 -5.009 5.324 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -15.256 -6.383 8.040 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -16.564 -5.351 7.497 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -15.659 -7.940 6.195 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -17.113 -7.709 7.146 1.00 0.00 H new ATOM 1838 N PHE A 110 -13.651 -4.082 8.048 1.00 0.00 N ATOM 1839 CA PHE A 110 -13.172 -2.910 8.779 1.00 0.00 C ATOM 1840 C PHE A 110 -12.324 -2.027 7.873 1.00 0.00 C ATOM 1841 O PHE A 110 -12.323 -0.803 8.007 1.00 0.00 O ATOM 1842 CB PHE A 110 -12.363 -3.322 10.012 1.00 0.00 C ATOM 1843 CG PHE A 110 -13.194 -3.870 11.136 1.00 0.00 C ATOM 1844 CD1 PHE A 110 -13.929 -3.021 11.945 1.00 0.00 C ATOM 1845 CD2 PHE A 110 -13.234 -5.231 11.388 1.00 0.00 C ATOM 1846 CE1 PHE A 110 -14.692 -3.518 12.983 1.00 0.00 C ATOM 1847 CE2 PHE A 110 -13.995 -5.734 12.424 1.00 0.00 C ATOM 1848 CZ PHE A 110 -14.725 -4.877 13.223 1.00 0.00 C ATOM 0 H PHE A 110 -13.365 -4.975 8.448 1.00 0.00 H new ATOM 0 HA PHE A 110 -14.043 -2.346 9.112 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -11.629 -4.072 9.718 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -11.807 -2.457 10.374 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -13.905 -1.957 11.762 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -12.664 -5.906 10.767 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -15.262 -2.845 13.606 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -14.019 -6.798 12.609 1.00 0.00 H new ATOM 0 HZ PHE A 110 -15.321 -5.269 14.034 1.00 0.00 H new ATOM 1858 N LEU A 111 -11.618 -2.662 6.948 1.00 0.00 N ATOM 1859 CA LEU A 111 -10.806 -1.961 5.965 1.00 0.00 C ATOM 1860 C LEU A 111 -11.688 -1.085 5.069 1.00 0.00 C ATOM 1861 O LEU A 111 -11.368 0.074 4.803 1.00 0.00 O ATOM 1862 CB LEU A 111 -10.018 -2.992 5.142 1.00 0.00 C ATOM 1863 CG LEU A 111 -9.056 -2.438 4.090 1.00 0.00 C ATOM 1864 CD1 LEU A 111 -7.826 -3.323 3.979 1.00 0.00 C ATOM 1865 CD2 LEU A 111 -9.738 -2.336 2.739 1.00 0.00 C ATOM 0 H LEU A 111 -11.592 -3.678 6.858 1.00 0.00 H new ATOM 0 HA LEU A 111 -10.101 -1.301 6.470 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -9.447 -3.614 5.832 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -10.732 -3.645 4.640 1.00 0.00 H new ATOM 0 HG LEU A 111 -8.750 -1.440 4.404 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -7.151 -2.915 3.226 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -7.316 -3.360 4.942 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -8.127 -4.330 3.689 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -9.036 -1.940 2.006 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -10.072 -3.325 2.424 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -10.598 -1.670 2.815 1.00 0.00 H new ATOM 1877 N ARG A 112 -12.817 -1.635 4.629 1.00 0.00 N ATOM 1878 CA ARG A 112 -13.745 -0.897 3.776 1.00 0.00 C ATOM 1879 C ARG A 112 -14.551 0.122 4.578 1.00 0.00 C ATOM 1880 O ARG A 112 -15.120 1.055 4.016 1.00 0.00 O ATOM 1881 CB ARG A 112 -14.695 -1.849 3.042 1.00 0.00 C ATOM 1882 CG ARG A 112 -14.014 -2.675 1.963 1.00 0.00 C ATOM 1883 CD ARG A 112 -15.022 -3.337 1.034 1.00 0.00 C ATOM 1884 NE ARG A 112 -15.727 -4.457 1.658 1.00 0.00 N ATOM 1885 CZ ARG A 112 -16.581 -5.249 0.999 1.00 0.00 C ATOM 1886 NH1 ARG A 112 -16.835 -5.023 -0.287 1.00 0.00 N ATOM 1887 NH2 ARG A 112 -17.168 -6.269 1.617 1.00 0.00 N ATOM 0 H ARG A 112 -13.111 -2.587 4.848 1.00 0.00 H new ATOM 0 HA ARG A 112 -13.146 -0.361 3.040 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -15.154 -2.521 3.767 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -15.500 -1.269 2.590 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -13.350 -2.036 1.382 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -13.393 -3.440 2.429 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -15.749 -2.594 0.708 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -14.507 -3.692 0.141 1.00 0.00 H new ATOM 0 HE ARG A 112 -15.559 -4.644 2.647 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -16.379 -4.248 -0.768 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -17.485 -5.625 -0.792 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -16.969 -6.453 2.600 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -17.818 -6.868 1.108 1.00 0.00 H new ATOM 1901 N ASN A 113 -14.599 -0.059 5.891 1.00 0.00 N ATOM 1902 CA ASN A 113 -15.343 0.844 6.769 1.00 0.00 C ATOM 1903 C ASN A 113 -14.400 1.756 7.549 1.00 0.00 C ATOM 1904 O ASN A 113 -14.777 2.335 8.567 1.00 0.00 O ATOM 1905 CB ASN A 113 -16.219 0.049 7.744 1.00 0.00 C ATOM 1906 CG ASN A 113 -17.544 -0.396 7.143 1.00 0.00 C ATOM 1907 OD1 ASN A 113 -18.534 -0.568 7.858 1.00 0.00 O ATOM 1908 ND2 ASN A 113 -17.585 -0.572 5.831 1.00 0.00 N ATOM 0 H ASN A 113 -14.131 -0.825 6.376 1.00 0.00 H new ATOM 0 HA ASN A 113 -15.982 1.464 6.140 1.00 0.00 H new ATOM 0 HB2 ASN A 113 -15.669 -0.829 8.081 1.00 0.00 H new ATOM 0 HB3 ASN A 113 -16.415 0.660 8.625 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -18.455 -0.859 5.382 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -16.747 -0.421 5.270 1.00 0.00 H new ATOM 1915 N TRP A 114 -13.169 1.872 7.072 1.00 0.00 N ATOM 1916 CA TRP A 114 -12.178 2.725 7.715 1.00 0.00 C ATOM 1917 C TRP A 114 -12.379 4.184 7.301 1.00 0.00 C ATOM 1918 O TRP A 114 -12.021 4.589 6.196 1.00 0.00 O ATOM 1919 CB TRP A 114 -10.765 2.247 7.361 1.00 0.00 C ATOM 1920 CG TRP A 114 -9.674 3.087 7.951 1.00 0.00 C ATOM 1921 CD1 TRP A 114 -9.293 3.143 9.261 1.00 0.00 C ATOM 1922 CD2 TRP A 114 -8.808 3.981 7.245 1.00 0.00 C ATOM 1923 NE1 TRP A 114 -8.252 4.028 9.412 1.00 0.00 N ATOM 1924 CE2 TRP A 114 -7.938 4.551 8.185 1.00 0.00 C ATOM 1925 CE3 TRP A 114 -8.694 4.357 5.903 1.00 0.00 C ATOM 1926 CZ2 TRP A 114 -6.960 5.475 7.831 1.00 0.00 C ATOM 1927 CZ3 TRP A 114 -7.723 5.276 5.554 1.00 0.00 C ATOM 1928 CH2 TRP A 114 -6.869 5.825 6.513 1.00 0.00 C ATOM 0 H TRP A 114 -12.832 1.386 6.241 1.00 0.00 H new ATOM 0 HA TRP A 114 -12.304 2.660 8.796 1.00 0.00 H new ATOM 0 HB2 TRP A 114 -10.644 1.219 7.703 1.00 0.00 H new ATOM 0 HB3 TRP A 114 -10.656 2.237 6.276 1.00 0.00 H new ATOM 0 HD1 TRP A 114 -9.744 2.575 10.061 1.00 0.00 H new ATOM 0 HE1 TRP A 114 -7.790 4.257 10.292 1.00 0.00 H new ATOM 0 HE3 TRP A 114 -9.351 3.938 5.155 1.00 0.00 H new ATOM 0 HZ2 TRP A 114 -6.297 5.900 8.570 1.00 0.00 H new ATOM 0 HZ3 TRP A 114 -7.623 5.575 4.521 1.00 0.00 H new ATOM 0 HH2 TRP A 114 -6.121 6.541 6.207 1.00 0.00 H new ATOM 1939 N ASN A 115 -12.962 4.972 8.192 1.00 0.00 N ATOM 1940 CA ASN A 115 -13.266 6.368 7.891 1.00 0.00 C ATOM 1941 C ASN A 115 -12.096 7.289 8.238 1.00 0.00 C ATOM 1942 O ASN A 115 -12.236 8.511 8.218 1.00 0.00 O ATOM 1943 CB ASN A 115 -14.531 6.817 8.634 1.00 0.00 C ATOM 1944 CG ASN A 115 -14.386 6.743 10.141 1.00 0.00 C ATOM 1945 OD1 ASN A 115 -14.651 5.704 10.747 1.00 0.00 O ATOM 1946 ND2 ASN A 115 -13.989 7.844 10.756 1.00 0.00 N ATOM 0 H ASN A 115 -13.235 4.672 9.128 1.00 0.00 H new ATOM 0 HA ASN A 115 -13.440 6.439 6.817 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -14.771 7.841 8.347 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -15.370 6.194 8.323 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -13.892 7.854 11.771 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -13.780 8.683 10.215 1.00 0.00 H new ATOM 1953 N GLY A 116 -10.944 6.706 8.545 1.00 0.00 N ATOM 1954 CA GLY A 116 -9.763 7.507 8.816 1.00 0.00 C ATOM 1955 C GLY A 116 -9.351 7.482 10.274 1.00 0.00 C ATOM 1956 O GLY A 116 -8.314 8.034 10.638 1.00 0.00 O ATOM 0 H GLY A 116 -10.805 5.698 8.611 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -8.937 7.144 8.205 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -9.953 8.537 8.516 1.00 0.00 H new ATOM 1960 N THR A 117 -10.163 6.847 11.107 1.00 0.00 N ATOM 1961 CA THR A 117 -9.884 6.752 12.532 1.00 0.00 C ATOM 1962 C THR A 117 -8.563 6.023 12.793 1.00 0.00 C ATOM 1963 O THR A 117 -8.350 4.911 12.304 1.00 0.00 O ATOM 1964 CB THR A 117 -11.025 6.010 13.252 1.00 0.00 C ATOM 1965 OG1 THR A 117 -12.288 6.492 12.779 1.00 0.00 O ATOM 1966 CG2 THR A 117 -10.940 6.203 14.759 1.00 0.00 C ATOM 0 H THR A 117 -11.026 6.387 10.817 1.00 0.00 H new ATOM 0 HA THR A 117 -9.804 7.767 12.920 1.00 0.00 H new ATOM 0 HB THR A 117 -10.929 4.946 13.035 1.00 0.00 H new ATOM 0 HG1 THR A 117 -13.012 6.017 13.238 1.00 0.00 H new ATOM 0 HG21 THR A 117 -11.758 5.668 15.241 1.00 0.00 H new ATOM 0 HG22 THR A 117 -9.989 5.815 15.122 1.00 0.00 H new ATOM 0 HG23 THR A 117 -11.012 7.265 14.994 1.00 0.00 H new ATOM 1974 N PHE A 118 -7.681 6.651 13.563 1.00 0.00 N ATOM 1975 CA PHE A 118 -6.400 6.042 13.902 1.00 0.00 C ATOM 1976 C PHE A 118 -6.605 4.880 14.868 1.00 0.00 C ATOM 1977 O PHE A 118 -5.929 3.855 14.774 1.00 0.00 O ATOM 1978 CB PHE A 118 -5.445 7.071 14.514 1.00 0.00 C ATOM 1979 CG PHE A 118 -5.027 8.155 13.560 1.00 0.00 C ATOM 1980 CD1 PHE A 118 -5.761 9.322 13.448 1.00 0.00 C ATOM 1981 CD2 PHE A 118 -3.892 8.003 12.781 1.00 0.00 C ATOM 1982 CE1 PHE A 118 -5.373 10.322 12.575 1.00 0.00 C ATOM 1983 CE2 PHE A 118 -3.499 8.999 11.906 1.00 0.00 C ATOM 1984 CZ PHE A 118 -4.240 10.159 11.803 1.00 0.00 C ATOM 0 H PHE A 118 -7.829 7.578 13.963 1.00 0.00 H new ATOM 0 HA PHE A 118 -5.953 5.666 12.982 1.00 0.00 H new ATOM 0 HB2 PHE A 118 -5.924 7.527 15.380 1.00 0.00 H new ATOM 0 HB3 PHE A 118 -4.555 6.556 14.877 1.00 0.00 H new ATOM 0 HD1 PHE A 118 -6.648 9.454 14.050 1.00 0.00 H new ATOM 0 HD2 PHE A 118 -3.308 7.098 12.858 1.00 0.00 H new ATOM 0 HE1 PHE A 118 -5.955 11.228 12.497 1.00 0.00 H new ATOM 0 HE2 PHE A 118 -2.612 8.869 11.303 1.00 0.00 H new ATOM 0 HZ PHE A 118 -3.934 10.938 11.120 1.00 0.00 H new ATOM 1994 N GLY A 119 -7.550 5.042 15.787 1.00 0.00 N ATOM 1995 CA GLY A 119 -7.876 3.984 16.727 1.00 0.00 C ATOM 1996 C GLY A 119 -8.551 2.800 16.059 1.00 0.00 C ATOM 1997 O GLY A 119 -8.630 1.710 16.630 1.00 0.00 O ATOM 0 H GLY A 119 -8.100 5.894 15.899 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -6.964 3.647 17.220 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -8.531 4.381 17.503 1.00 0.00 H new ATOM 2001 N LEU A 120 -9.032 3.011 14.840 1.00 0.00 N ATOM 2002 CA LEU A 120 -9.664 1.948 14.071 1.00 0.00 C ATOM 2003 C LEU A 120 -8.593 0.964 13.612 1.00 0.00 C ATOM 2004 O LEU A 120 -8.854 -0.218 13.413 1.00 0.00 O ATOM 2005 CB LEU A 120 -10.415 2.545 12.871 1.00 0.00 C ATOM 2006 CG LEU A 120 -11.613 1.738 12.347 1.00 0.00 C ATOM 2007 CD1 LEU A 120 -12.444 2.591 11.401 1.00 0.00 C ATOM 2008 CD2 LEU A 120 -11.163 0.468 11.639 1.00 0.00 C ATOM 0 H LEU A 120 -8.996 3.911 14.362 1.00 0.00 H new ATOM 0 HA LEU A 120 -10.388 1.419 14.690 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -10.767 3.539 13.148 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -9.706 2.674 12.053 1.00 0.00 H new ATOM 0 HG LEU A 120 -12.221 1.449 13.204 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -13.290 2.010 11.035 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -12.810 3.471 11.931 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -11.828 2.905 10.558 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -12.036 -0.078 11.281 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -10.527 0.729 10.793 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -10.604 -0.158 12.335 1.00 0.00 H new ATOM 2020 N LEU A 121 -7.366 1.455 13.493 1.00 0.00 N ATOM 2021 CA LEU A 121 -6.245 0.615 13.093 1.00 0.00 C ATOM 2022 C LEU A 121 -5.977 -0.452 14.149 1.00 0.00 C ATOM 2023 O LEU A 121 -5.371 -1.481 13.865 1.00 0.00 O ATOM 2024 CB LEU A 121 -4.992 1.465 12.867 1.00 0.00 C ATOM 2025 CG LEU A 121 -5.130 2.555 11.802 1.00 0.00 C ATOM 2026 CD1 LEU A 121 -3.843 3.356 11.695 1.00 0.00 C ATOM 2027 CD2 LEU A 121 -5.495 1.949 10.453 1.00 0.00 C ATOM 0 H LEU A 121 -7.122 2.430 13.668 1.00 0.00 H new ATOM 0 HA LEU A 121 -6.502 0.121 12.156 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -4.715 1.934 13.811 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -4.171 0.806 12.586 1.00 0.00 H new ATOM 0 HG LEU A 121 -5.934 3.227 12.102 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -3.957 4.127 10.933 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -3.624 3.823 12.655 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -3.023 2.692 11.420 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -5.588 2.742 9.711 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -4.715 1.253 10.144 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -6.443 1.418 10.537 1.00 0.00 H new ATOM 2039 N ASN A 122 -6.459 -0.208 15.364 1.00 0.00 N ATOM 2040 CA ASN A 122 -6.315 -1.166 16.453 1.00 0.00 C ATOM 2041 C ASN A 122 -7.307 -2.315 16.294 1.00 0.00 C ATOM 2042 O ASN A 122 -7.148 -3.376 16.899 1.00 0.00 O ATOM 2043 CB ASN A 122 -6.522 -0.484 17.810 1.00 0.00 C ATOM 2044 CG ASN A 122 -5.471 0.570 18.109 1.00 0.00 C ATOM 2045 OD1 ASN A 122 -5.650 1.751 17.799 1.00 0.00 O ATOM 2046 ND2 ASN A 122 -4.367 0.155 18.712 1.00 0.00 N ATOM 0 H ASN A 122 -6.954 0.647 15.619 1.00 0.00 H new ATOM 0 HA ASN A 122 -5.302 -1.566 16.414 1.00 0.00 H new ATOM 0 HB2 ASN A 122 -7.509 -0.022 17.832 1.00 0.00 H new ATOM 0 HB3 ASN A 122 -6.506 -1.239 18.596 1.00 0.00 H new ATOM 0 HD21 ASN A 122 -3.627 0.821 18.936 1.00 0.00 H new ATOM 0 HD22 ASN A 122 -4.257 -0.830 18.952 1.00 0.00 H new ATOM 2053 N THR A 123 -8.335 -2.104 15.478 1.00 0.00 N ATOM 2054 CA THR A 123 -9.313 -3.152 15.215 1.00 0.00 C ATOM 2055 C THR A 123 -8.930 -3.917 13.952 1.00 0.00 C ATOM 2056 O THR A 123 -9.511 -4.953 13.627 1.00 0.00 O ATOM 2057 CB THR A 123 -10.745 -2.586 15.082 1.00 0.00 C ATOM 2058 OG1 THR A 123 -10.871 -1.782 13.906 1.00 0.00 O ATOM 2059 CG2 THR A 123 -11.102 -1.744 16.298 1.00 0.00 C ATOM 0 H THR A 123 -8.511 -1.225 14.992 1.00 0.00 H new ATOM 0 HA THR A 123 -9.308 -3.831 16.068 1.00 0.00 H new ATOM 0 HB THR A 123 -11.427 -3.433 15.011 1.00 0.00 H new ATOM 0 HG1 THR A 123 -9.986 -1.465 13.630 1.00 0.00 H new ATOM 0 HG21 THR A 123 -12.114 -1.354 16.186 1.00 0.00 H new ATOM 0 HG22 THR A 123 -11.048 -2.360 17.196 1.00 0.00 H new ATOM 0 HG23 THR A 123 -10.401 -0.914 16.384 1.00 0.00 H new ATOM 2067 N LEU A 124 -7.927 -3.398 13.259 1.00 0.00 N ATOM 2068 CA LEU A 124 -7.423 -4.015 12.048 1.00 0.00 C ATOM 2069 C LEU A 124 -6.185 -4.839 12.353 1.00 0.00 C ATOM 2070 O LEU A 124 -5.267 -4.368 13.024 1.00 0.00 O ATOM 2071 CB LEU A 124 -7.099 -2.942 11.006 1.00 0.00 C ATOM 2072 CG LEU A 124 -8.319 -2.309 10.338 1.00 0.00 C ATOM 2073 CD1 LEU A 124 -7.918 -1.091 9.523 1.00 0.00 C ATOM 2074 CD2 LEU A 124 -9.015 -3.330 9.454 1.00 0.00 C ATOM 0 H LEU A 124 -7.443 -2.540 13.522 1.00 0.00 H new ATOM 0 HA LEU A 124 -8.191 -4.675 11.646 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -6.515 -2.156 11.484 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -6.468 -3.383 10.235 1.00 0.00 H new ATOM 0 HG LEU A 124 -9.009 -1.984 11.116 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -8.803 -0.658 9.057 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -7.454 -0.353 10.177 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -7.209 -1.388 8.750 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -9.883 -2.871 8.982 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -8.325 -3.676 8.685 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -9.337 -4.177 10.060 1.00 0.00 H new ATOM 2086 N ARG A 125 -6.167 -6.076 11.882 1.00 0.00 N ATOM 2087 CA ARG A 125 -4.998 -6.919 12.047 1.00 0.00 C ATOM 2088 C ARG A 125 -3.935 -6.542 11.030 1.00 0.00 C ATOM 2089 O ARG A 125 -3.787 -7.169 9.979 1.00 0.00 O ATOM 2090 CB ARG A 125 -5.362 -8.400 11.954 1.00 0.00 C ATOM 2091 CG ARG A 125 -6.011 -8.918 13.225 1.00 0.00 C ATOM 2092 CD ARG A 125 -6.449 -10.365 13.097 1.00 0.00 C ATOM 2093 NE ARG A 125 -6.905 -10.897 14.379 1.00 0.00 N ATOM 2094 CZ ARG A 125 -8.118 -10.681 14.889 1.00 0.00 C ATOM 2095 NH1 ARG A 125 -9.013 -9.964 14.212 1.00 0.00 N ATOM 2096 NH2 ARG A 125 -8.432 -11.180 16.078 1.00 0.00 N ATOM 0 H ARG A 125 -6.943 -6.514 11.386 1.00 0.00 H new ATOM 0 HA ARG A 125 -4.591 -6.754 13.045 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -6.041 -8.552 11.115 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -4.463 -8.980 11.746 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -5.309 -8.825 14.053 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -6.875 -8.299 13.468 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -7.252 -10.441 12.363 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -5.620 -10.967 12.725 1.00 0.00 H new ATOM 0 HE ARG A 125 -6.255 -11.469 14.918 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -8.772 -9.577 13.299 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -9.940 -9.801 14.606 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -7.746 -11.727 16.599 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -9.359 -11.017 16.471 1.00 0.00 H new ATOM 2110 N LEU A 126 -3.243 -5.464 11.341 1.00 0.00 N ATOM 2111 CA LEU A 126 -2.173 -4.959 10.511 1.00 0.00 C ATOM 2112 C LEU A 126 -0.868 -5.611 10.929 1.00 0.00 C ATOM 2113 O LEU A 126 -0.326 -5.322 11.997 1.00 0.00 O ATOM 2114 CB LEU A 126 -2.096 -3.439 10.653 1.00 0.00 C ATOM 2115 CG LEU A 126 -3.400 -2.708 10.325 1.00 0.00 C ATOM 2116 CD1 LEU A 126 -3.343 -1.266 10.793 1.00 0.00 C ATOM 2117 CD2 LEU A 126 -3.684 -2.768 8.833 1.00 0.00 C ATOM 0 H LEU A 126 -3.410 -4.912 12.182 1.00 0.00 H new ATOM 0 HA LEU A 126 -2.362 -5.198 9.464 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -1.804 -3.196 11.675 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -1.309 -3.064 9.999 1.00 0.00 H new ATOM 0 HG LEU A 126 -4.211 -3.208 10.854 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -4.281 -0.767 10.549 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -3.188 -1.239 11.872 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -2.519 -0.754 10.295 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -4.615 -2.243 8.618 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -2.867 -2.295 8.288 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -3.774 -3.809 8.521 1.00 0.00 H new ATOM 2129 N ILE A 127 -0.390 -6.514 10.098 1.00 0.00 N ATOM 2130 CA ILE A 127 0.790 -7.296 10.417 1.00 0.00 C ATOM 2131 C ILE A 127 1.982 -6.836 9.594 1.00 0.00 C ATOM 2132 O ILE A 127 1.893 -5.869 8.836 1.00 0.00 O ATOM 2133 CB ILE A 127 0.541 -8.800 10.168 1.00 0.00 C ATOM 2134 CG1 ILE A 127 0.020 -9.022 8.740 1.00 0.00 C ATOM 2135 CG2 ILE A 127 -0.437 -9.353 11.196 1.00 0.00 C ATOM 2136 CD1 ILE A 127 -0.267 -10.471 8.407 1.00 0.00 C ATOM 0 H ILE A 127 -0.803 -6.727 9.190 1.00 0.00 H new ATOM 0 HA ILE A 127 1.008 -7.145 11.474 1.00 0.00 H new ATOM 0 HB ILE A 127 1.484 -9.336 10.275 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -0.892 -8.441 8.603 1.00 0.00 H new ATOM 0 HG13 ILE A 127 0.754 -8.636 8.032 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -0.602 -10.414 11.007 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -0.025 -9.222 12.197 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -1.384 -8.819 11.121 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -0.631 -10.544 7.382 1.00 0.00 H new ATOM 0 HD12 ILE A 127 0.647 -11.056 8.510 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -1.024 -10.858 9.089 1.00 0.00 H new ATOM 2148 N ARG A 128 3.093 -7.529 9.745 1.00 0.00 N ATOM 2149 CA ARG A 128 4.287 -7.221 8.983 1.00 0.00 C ATOM 2150 C ARG A 128 4.374 -8.130 7.772 1.00 0.00 C ATOM 2151 O ARG A 128 4.567 -9.336 7.903 1.00 0.00 O ATOM 2152 CB ARG A 128 5.535 -7.379 9.851 1.00 0.00 C ATOM 2153 CG ARG A 128 5.752 -6.234 10.827 1.00 0.00 C ATOM 2154 CD ARG A 128 6.800 -6.588 11.870 1.00 0.00 C ATOM 2155 NE ARG A 128 7.218 -5.427 12.657 1.00 0.00 N ATOM 2156 CZ ARG A 128 6.461 -4.818 13.574 1.00 0.00 C ATOM 2157 NH1 ARG A 128 5.224 -5.233 13.818 1.00 0.00 N ATOM 2158 NH2 ARG A 128 6.954 -3.792 14.255 1.00 0.00 N ATOM 0 H ARG A 128 3.194 -8.312 10.391 1.00 0.00 H new ATOM 0 HA ARG A 128 4.230 -6.185 8.649 1.00 0.00 H new ATOM 0 HB2 ARG A 128 5.462 -8.312 10.410 1.00 0.00 H new ATOM 0 HB3 ARG A 128 6.408 -7.463 9.204 1.00 0.00 H new ATOM 0 HG2 ARG A 128 6.065 -5.343 10.282 1.00 0.00 H new ATOM 0 HG3 ARG A 128 4.811 -5.992 11.321 1.00 0.00 H new ATOM 0 HD2 ARG A 128 6.401 -7.352 12.538 1.00 0.00 H new ATOM 0 HD3 ARG A 128 7.670 -7.020 11.375 1.00 0.00 H new ATOM 0 HE ARG A 128 8.154 -5.056 12.494 1.00 0.00 H new ATOM 0 HH11 ARG A 128 4.841 -6.026 13.303 1.00 0.00 H new ATOM 0 HH12 ARG A 128 4.656 -4.759 14.521 1.00 0.00 H new ATOM 0 HH21 ARG A 128 7.906 -3.472 14.077 1.00 0.00 H new ATOM 0 HH22 ARG A 128 6.381 -3.323 14.956 1.00 0.00 H new ATOM 2172 N ILE A 129 4.202 -7.555 6.600 1.00 0.00 N ATOM 2173 CA ILE A 129 4.311 -8.301 5.360 1.00 0.00 C ATOM 2174 C ILE A 129 5.481 -7.766 4.554 1.00 0.00 C ATOM 2175 O ILE A 129 5.653 -6.552 4.423 1.00 0.00 O ATOM 2176 CB ILE A 129 3.009 -8.222 4.534 1.00 0.00 C ATOM 2177 CG1 ILE A 129 1.859 -8.893 5.298 1.00 0.00 C ATOM 2178 CG2 ILE A 129 3.187 -8.862 3.163 1.00 0.00 C ATOM 2179 CD1 ILE A 129 0.554 -8.934 4.532 1.00 0.00 C ATOM 0 H ILE A 129 3.984 -6.566 6.478 1.00 0.00 H new ATOM 0 HA ILE A 129 4.480 -9.350 5.602 1.00 0.00 H new ATOM 0 HB ILE A 129 2.765 -7.171 4.380 1.00 0.00 H new ATOM 0 HG12 ILE A 129 2.151 -9.912 5.553 1.00 0.00 H new ATOM 0 HG13 ILE A 129 1.701 -8.362 6.237 1.00 0.00 H new ATOM 0 HG21 ILE A 129 2.254 -8.791 2.604 1.00 0.00 H new ATOM 0 HG22 ILE A 129 3.976 -8.343 2.619 1.00 0.00 H new ATOM 0 HG23 ILE A 129 3.459 -9.911 3.284 1.00 0.00 H new ATOM 0 HD11 ILE A 129 -0.209 -9.423 5.138 1.00 0.00 H new ATOM 0 HD12 ILE A 129 0.236 -7.918 4.300 1.00 0.00 H new ATOM 0 HD13 ILE A 129 0.693 -9.491 3.606 1.00 0.00 H new ATOM 2191 N ASN A 130 6.296 -8.666 4.034 1.00 0.00 N ATOM 2192 CA ASN A 130 7.513 -8.262 3.356 1.00 0.00 C ATOM 2193 C ASN A 130 7.733 -9.067 2.080 1.00 0.00 C ATOM 2194 O ASN A 130 7.109 -10.119 1.873 1.00 0.00 O ATOM 2195 CB ASN A 130 8.711 -8.433 4.302 1.00 0.00 C ATOM 2196 CG ASN A 130 10.003 -7.888 3.727 1.00 0.00 C ATOM 2197 OD1 ASN A 130 9.991 -6.950 2.940 1.00 0.00 O ATOM 2198 ND2 ASN A 130 11.123 -8.484 4.106 1.00 0.00 N ATOM 0 H ASN A 130 6.139 -9.673 4.068 1.00 0.00 H new ATOM 0 HA ASN A 130 7.416 -7.213 3.075 1.00 0.00 H new ATOM 0 HB2 ASN A 130 8.498 -7.928 5.244 1.00 0.00 H new ATOM 0 HB3 ASN A 130 8.839 -9.491 4.529 1.00 0.00 H new ATOM 0 HD21 ASN A 130 12.020 -8.164 3.740 1.00 0.00 H new ATOM 0 HD22 ASN A 130 11.089 -9.263 4.764 1.00 0.00 H new ATOM 2205 N ASP A 131 8.600 -8.523 1.227 1.00 0.00 N ATOM 2206 CA ASP A 131 9.111 -9.197 0.040 1.00 0.00 C ATOM 2207 C ASP A 131 8.047 -9.344 -1.041 1.00 0.00 C ATOM 2208 O ASP A 131 7.924 -8.487 -1.914 1.00 0.00 O ATOM 2209 CB ASP A 131 9.715 -10.554 0.416 1.00 0.00 C ATOM 2210 CG ASP A 131 10.339 -11.273 -0.759 1.00 0.00 C ATOM 2211 OD1 ASP A 131 11.417 -10.848 -1.217 1.00 0.00 O ATOM 2212 OD2 ASP A 131 9.762 -12.285 -1.215 1.00 0.00 O ATOM 0 H ASP A 131 8.973 -7.581 1.347 1.00 0.00 H new ATOM 0 HA ASP A 131 9.898 -8.572 -0.381 1.00 0.00 H new ATOM 0 HB2 ASP A 131 10.471 -10.407 1.187 1.00 0.00 H new ATOM 0 HB3 ASP A 131 8.937 -11.184 0.848 1.00 0.00 H new ATOM 2217 N LYS A 132 7.272 -10.415 -0.985 1.00 0.00 N ATOM 2218 CA LYS A 132 6.280 -10.672 -2.015 1.00 0.00 C ATOM 2219 C LYS A 132 4.948 -11.105 -1.417 1.00 0.00 C ATOM 2220 O LYS A 132 4.135 -11.734 -2.090 1.00 0.00 O ATOM 2221 CB LYS A 132 6.799 -11.726 -2.999 1.00 0.00 C ATOM 2222 CG LYS A 132 7.884 -11.204 -3.936 1.00 0.00 C ATOM 2223 CD LYS A 132 8.314 -12.248 -4.961 1.00 0.00 C ATOM 2224 CE LYS A 132 9.438 -13.140 -4.446 1.00 0.00 C ATOM 2225 NZ LYS A 132 9.075 -13.859 -3.198 1.00 0.00 N ATOM 0 H LYS A 132 7.310 -11.115 -0.244 1.00 0.00 H new ATOM 0 HA LYS A 132 6.108 -9.740 -2.553 1.00 0.00 H new ATOM 0 HB2 LYS A 132 7.192 -12.573 -2.437 1.00 0.00 H new ATOM 0 HB3 LYS A 132 5.965 -12.098 -3.594 1.00 0.00 H new ATOM 0 HG2 LYS A 132 7.518 -10.318 -4.455 1.00 0.00 H new ATOM 0 HG3 LYS A 132 8.750 -10.895 -3.350 1.00 0.00 H new ATOM 0 HD2 LYS A 132 7.457 -12.866 -5.228 1.00 0.00 H new ATOM 0 HD3 LYS A 132 8.641 -11.746 -5.872 1.00 0.00 H new ATOM 0 HE2 LYS A 132 9.701 -13.866 -5.215 1.00 0.00 H new ATOM 0 HE3 LYS A 132 10.324 -12.532 -4.265 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 9.723 -14.660 -3.058 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 9.147 -13.209 -2.389 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 8.100 -14.212 -3.272 1.00 0.00 H new ATOM 2239 N GLY A 133 4.724 -10.748 -0.162 1.00 0.00 N ATOM 2240 CA GLY A 133 3.426 -10.977 0.442 1.00 0.00 C ATOM 2241 C GLY A 133 3.439 -12.057 1.502 1.00 0.00 C ATOM 2242 O GLY A 133 2.435 -12.742 1.704 1.00 0.00 O ATOM 0 H GLY A 133 5.412 -10.306 0.447 1.00 0.00 H new ATOM 0 HA2 GLY A 133 3.071 -10.047 0.886 1.00 0.00 H new ATOM 0 HA3 GLY A 133 2.714 -11.251 -0.337 1.00 0.00 H new ATOM 2246 N GLU A 134 4.560 -12.210 2.190 1.00 0.00 N ATOM 2247 CA GLU A 134 4.653 -13.200 3.252 1.00 0.00 C ATOM 2248 C GLU A 134 4.645 -12.532 4.619 1.00 0.00 C ATOM 2249 O GLU A 134 5.177 -11.431 4.792 1.00 0.00 O ATOM 2250 CB GLU A 134 5.898 -14.071 3.083 1.00 0.00 C ATOM 2251 CG GLU A 134 5.793 -15.037 1.915 1.00 0.00 C ATOM 2252 CD GLU A 134 7.016 -15.914 1.771 1.00 0.00 C ATOM 2253 OE1 GLU A 134 7.141 -16.895 2.533 1.00 0.00 O ATOM 2254 OE2 GLU A 134 7.859 -15.625 0.896 1.00 0.00 O ATOM 0 H GLU A 134 5.410 -11.668 2.035 1.00 0.00 H new ATOM 0 HA GLU A 134 3.778 -13.846 3.184 1.00 0.00 H new ATOM 0 HB2 GLU A 134 6.767 -13.429 2.939 1.00 0.00 H new ATOM 0 HB3 GLU A 134 6.067 -14.635 4.000 1.00 0.00 H new ATOM 0 HG2 GLU A 134 4.913 -15.667 2.048 1.00 0.00 H new ATOM 0 HG3 GLU A 134 5.645 -14.473 0.994 1.00 0.00 H new ATOM 2261 N GLN A 135 4.021 -13.204 5.578 1.00 0.00 N ATOM 2262 CA GLN A 135 3.867 -12.676 6.924 1.00 0.00 C ATOM 2263 C GLN A 135 5.160 -12.827 7.717 1.00 0.00 C ATOM 2264 O GLN A 135 5.662 -13.936 7.914 1.00 0.00 O ATOM 2265 CB GLN A 135 2.719 -13.394 7.636 1.00 0.00 C ATOM 2266 CG GLN A 135 2.429 -12.867 9.031 1.00 0.00 C ATOM 2267 CD GLN A 135 1.246 -13.560 9.676 1.00 0.00 C ATOM 2268 OE1 GLN A 135 0.325 -14.008 8.991 1.00 0.00 O ATOM 2269 NE2 GLN A 135 1.256 -13.647 10.995 1.00 0.00 N ATOM 0 H GLN A 135 3.609 -14.127 5.444 1.00 0.00 H new ATOM 0 HA GLN A 135 3.635 -11.613 6.856 1.00 0.00 H new ATOM 0 HB2 GLN A 135 1.817 -13.304 7.030 1.00 0.00 H new ATOM 0 HB3 GLN A 135 2.954 -14.456 7.702 1.00 0.00 H new ATOM 0 HG2 GLN A 135 3.311 -13.001 9.658 1.00 0.00 H new ATOM 0 HG3 GLN A 135 2.235 -11.796 8.979 1.00 0.00 H new ATOM 0 HE21 GLN A 135 2.038 -13.263 11.526 1.00 0.00 H new ATOM 0 HE22 GLN A 135 0.482 -14.098 11.482 1.00 0.00 H new ATOM 2278 N VAL A 136 5.690 -11.703 8.161 1.00 0.00 N ATOM 2279 CA VAL A 136 6.921 -11.674 8.930 1.00 0.00 C ATOM 2280 C VAL A 136 6.601 -11.617 10.418 1.00 0.00 C ATOM 2281 O VAL A 136 6.137 -10.594 10.921 1.00 0.00 O ATOM 2282 CB VAL A 136 7.784 -10.449 8.558 1.00 0.00 C ATOM 2283 CG1 VAL A 136 9.198 -10.592 9.103 1.00 0.00 C ATOM 2284 CG2 VAL A 136 7.795 -10.233 7.051 1.00 0.00 C ATOM 0 H VAL A 136 5.279 -10.783 7.999 1.00 0.00 H new ATOM 0 HA VAL A 136 7.479 -12.581 8.699 1.00 0.00 H new ATOM 0 HB VAL A 136 7.338 -9.568 9.020 1.00 0.00 H new ATOM 0 HG11 VAL A 136 9.785 -9.716 8.827 1.00 0.00 H new ATOM 0 HG12 VAL A 136 9.162 -10.677 10.189 1.00 0.00 H new ATOM 0 HG13 VAL A 136 9.661 -11.485 8.684 1.00 0.00 H new ATOM 0 HG21 VAL A 136 8.409 -9.365 6.812 1.00 0.00 H new ATOM 0 HG22 VAL A 136 8.207 -11.115 6.560 1.00 0.00 H new ATOM 0 HG23 VAL A 136 6.777 -10.065 6.700 1.00 0.00 H new ATOM 2294 N VAL A 137 6.826 -12.718 11.115 1.00 0.00 N ATOM 2295 CA VAL A 137 6.560 -12.769 12.546 1.00 0.00 C ATOM 2296 C VAL A 137 7.804 -12.391 13.340 1.00 0.00 C ATOM 2297 O VAL A 137 8.892 -12.254 12.774 1.00 0.00 O ATOM 2298 CB VAL A 137 6.065 -14.163 12.989 1.00 0.00 C ATOM 2299 CG1 VAL A 137 4.742 -14.493 12.318 1.00 0.00 C ATOM 2300 CG2 VAL A 137 7.104 -15.231 12.685 1.00 0.00 C ATOM 0 H VAL A 137 7.190 -13.584 10.718 1.00 0.00 H new ATOM 0 HA VAL A 137 5.769 -12.047 12.749 1.00 0.00 H new ATOM 0 HB VAL A 137 5.910 -14.144 14.068 1.00 0.00 H new ATOM 0 HG11 VAL A 137 4.406 -15.479 12.640 1.00 0.00 H new ATOM 0 HG12 VAL A 137 3.997 -13.747 12.596 1.00 0.00 H new ATOM 0 HG13 VAL A 137 4.872 -14.490 11.236 1.00 0.00 H new ATOM 0 HG21 VAL A 137 6.731 -16.203 13.007 1.00 0.00 H new ATOM 0 HG22 VAL A 137 7.299 -15.254 11.613 1.00 0.00 H new ATOM 0 HG23 VAL A 137 8.027 -15.002 13.217 1.00 0.00 H new